| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 40.6 | Very low | 46.7 | Very low | 241 Ų | 241 | 168.2 Ų | 168.2 | 100% | 1.187 | 86% | 0.861 | S | S | * | * | 0 | 109.2 | 0 | -73.6 | 172.8 | 174 | 0 | 0 | 106.8 | |||||
| 2 | E | 38.4 | Very low | 47.3 | Very low | 190 Ų | 190 | 159.2 Ų | 159.2 | 89% | 0.888 | 84% | 0.841 | S | S | * | * | trans | -76.4 | 144.8 | 176.1 | -68.4 | 161.7 | 104 | 0 | 0 | 110.1 | ||||
| 3 | M | 44.3 | Very low | 47.9 | Very low | 180 Ų | 180 | 160.3 Ų | 160.3 | 89% | 0.887 | 83% | 0.829 | S | S | * | * | trans | -107.6 | 99.3 | 172.9 | -67 | -164.6 | -101.1 | 0 | 0 | 108.2 | E5 | M3-E5 PolarHBondContact O-N 2.94Å; M3-E5 VanDerWaalsContact O-N 3.13Å | ||
| 4 | C | 47 | Very low | 48.7 | Very low | 112 Ų | 112 | 158.6 Ų | 158.6 | 76% | 0.757 | 83% | 0.828 | S | S | * | * | trans | -62.3 | 114.1 | -173.2 | -57.3 | 0 | 0 | 0 | 0 | 112.2 | R6 | C4-R6 PolarHBondContact O-N 3.13Å; C4-R6 VanDerWaalsContact O-N 3.08Å | ||
| 5 | E | 48.9 | Very low | 48.7 | Very low | 175 Ų | 175 | 150.7 Ų | 150.7 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | trans | -65.9 | 105.5 | 177.7 | -63.5 | -169.3 | 139.5 | 0 | 0 | 111.6 | M3 N7 | M3-E5 PolarHBondContact O-N 2.94Å; M3-E5 VanDerWaalsContact O-N 3.13Å; E5-N7 PolarHBondContact O-N 3.48Å; E5-N7 PolarHBondContact O-ND2 3.08Å | ||
| 6 | R | 50.8 | Low | 49.1 | Very low | 214 Ų | 214 | 146.9 Ų | 146.9 | 81% | 0.808 | 79% | 0.79 | S | S | * | * | trans | -76 | 89.6 | 178.4 | -69.3 | -169.6 | 176.5 | 110.8 | -0 | 110.9 | C4 L8 | C4-R6 PolarHBondContact O-N 3.13Å; C4-R6 VanDerWaalsContact O-N 3.08Å; R6-L8 WeakPolarHBondContact O-CD1 3.28Å; R6-L8 PolarHBondContact O-N 2.96Å | ||
| 7 | N | 44.3 | Very low | 49.5 | Very low | 129 Ų | 129 | 148.6 Ų | 148.6 | 69% | 0.69 | 80% | 0.798 | S | S | * | * | trans | -57.8 | 111.8 | 174.1 | -84.4 | -101.4 | 0 | 0 | 0 | 111.5 | E5 L9 | E5-N7 PolarHBondContact O-N 3.48Å; E5-N7 PolarHBondContact O-ND2 3.08Å; N7-L9 PolarHBondContact O-N 3.19Å | ||
| 8 | L | 53.6 | Low | 49.8 | Very low | 174 Ų | 174 | 147.6 Ų | 147.6 | 91% | 0.911 | 79% | 0.792 | S | S | * | * | trans | -77.6 | 2.5 | -178.9 | -74.2 | 102.6 | 0 | 0 | 0 | 114.6 | R6 N10 | R6-L8 WeakPolarHBondContact O-CD1 3.28Å; R6-L8 PolarHBondContact O-N 2.96Å; L8-N10 PolarHBondContact O-N 3.18Å | ||
| 9 | L | 55.5 | Low | 49.7 | Very low | 174 Ų | 174 | 147.9 Ų | 147.9 | 91% | 0.911 | 79% | 0.793 | S | S | * | * | trans | -100.6 | 41.4 | -171.7 | -70.1 | 169.9 | 0 | 0 | 0 | 113.6 | N7 | N7-L9 PolarHBondContact O-N 3.19Š| ||
| 10 | N | 40.7 | Very low | 49.3 | Very low | 126 Ų | 126 | 149.2 Ų | 149.2 | 67% | 0.674 | 79% | 0.791 | S | S | * | * | trans | -119.6 | 124.5 | 174.5 | -164.2 | -11.5 | 0 | 0 | 0 | 111.8 | L8 G12 Y13 | L8-N10 PolarHBondContact O-N 3.18Å; N10-G12 PolarHBondContact O-N 3.27Å; N10-Y13 PolarHBondContact O-N 2.85Å | ||
| 11 | S | 50.1 | Low | 49.1 | Very low | 135 Ų | 135 | 147.3 Ų | 147.3 | 94% | 0.944 | 79% | 0.788 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.6 | 21 | -167 | -170.3 | 0 | 0 | 0 | 0 | 115.6 | ||
| 12 | G | 53.4 | Low | 49.2 | Very low | 60 Ų | 60 | 141.2 Ų | 141.2 | 62% | 0.619 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -139.9 | 6.4 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | N10 V14 | N10-G12 PolarHBondContact O-N 3.27Å; G12-V14 PolarHBondContact O-N 3.47Å |
| 13 | Y | 55.2 | Low | 49.7 | Very low | 174 Ų | 174 | 138.5 Ų | 138.5 | 68% | 0.682 | 76% | 0.763 | S | S | * | * | trans | -77.3 | 93 | -178 | -169.3 | -105.2 | 0 | 0 | 0 | 112 | N10 G15 | N10-Y13 PolarHBondContact O-N 2.85Å; Y13-G15 PolarHBondContact O-N 3.47Å; Y13-G15 VanDerWaalsContact O-N 3.09Å | ||
| 14 | V | 59 | Low | 49.8 | Very low | 136 Ų | 136 | 138.5 Ų | 138.5 | 82% | 0.824 | 76% | 0.761 | S | S | * | * | trans | -74.3 | 95.9 | 168.1 | -169.9 | 0 | 0 | 0 | 0 | 108 | G12 | G12-V14 PolarHBondContact O-N 3.47Š| ||
| 15 | G | 48.4 | Very low | 49.8 | Very low | 41 Ų | 41 | 138 Ų | 138 | 42% | 0.423 | 76% | 0.759 | S | S | . | * | trans | -55.7 | 136.8 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y13 L17 | Y13-G15 PolarHBondContact O-N 3.47Å; Y13-G15 VanDerWaalsContact O-N 3.09Å; G15-L17 PolarHBondContact O-N 3.45Å | ||
| 16 | S | 56.3 | Low | 50.1 | Low | 89 Ų | 89 | 137.3 Ų | 137.3 | 62% | 0.622 | 76% | 0.76 | S | S | * | * | trans | -57.1 | 134.9 | -177 | -52.3 | 0 | 0 | 0 | 0 | 112.3 | L18 | S16-L18 PolarHBondContact O-N 3.14Š| ||
| 17 | L | 55.2 | Low | 50 | Low | 177 Ų | 177 | 136.9 Ų | 136.9 | 93% | 0.927 | 76% | 0.76 | S | S | * | * | trans | -73.5 | 60.3 | 176.9 | -66.7 | 171.1 | 0 | 0 | 0 | 112.1 | G15 N19 | G15-L17 PolarHBondContact O-N 3.45Å; L17-N19 PolarHBondContact O-N 3Å | ||
| 18 | L | 54.1 | Low | 50.1 | Low | 130 Ų | 130 | 139.7 Ų | 139.7 | 68% | 0.681 | 77% | 0.766 | S | S | * | * | trans | -88.3 | 98.9 | 170.6 | -69.9 | -179.7 | 0 | 0 | 0 | 109.6 | S16 F20 | S16-L18 PolarHBondContact O-N 3.14Å; L18-F20 HydrophobicContact CB-CD2 4.27Å; L18-F20 HydrophobicContact CB-CE2 3.9Å; L18-F20 WeakPolarHBondContact O-CD2 3.28Å; L18-F20 PolarHBondContact O-N 3.28Å | ||
| 19 | N | 49.2 | Very low | 50 | Low | 153 Ų | 153 | 136.4 Ų | 136.4 | 82% | 0.818 | 76% | 0.758 | S | S | * | * | trans | -72 | 83 | -178.6 | -176.2 | 28.2 | 0 | 0 | 0 | 111.3 | L17 P21 | L17-N19 PolarHBondContact O-N 3Å; N19-P21 WeakPolarHBondContact O-CD 3.5Å | ||
| 20 | F | 42.1 | Very low | 49.6 | Very low | 173 Ų | 173 | 135.5 Ų | 135.5 | 76% | 0.759 | 75% | 0.754 | S | S | * | * | trans | -83.2 | 113 | 167.6 | -70.8 | -78.1 | 0 | 0 | 0 | 109.6 | L18 T22 | L18-F20 HydrophobicContact CB-CD2 4.27Å; L18-F20 HydrophobicContact CB-CE2 3.9Å; L18-F20 WeakPolarHBondContact O-CD2 3.28Å; L18-F20 PolarHBondContact O-N 3.28Å; F20-T22 PolarHBondContact O-N 2.7Å | ||
| 21 | P | 43.5 | Very low | 50.2 | Low | 111 Ų | 111 | 137.2 Ų | 137.2 | 72% | 0.721 | 76% | 0.762 | S | S | * | * | trans | -75.6 | 113.4 | -177.6 | 29.6 | -33.6 | 0 | 0 | 0 | 111.2 | N19 | N19-P21 WeakPolarHBondContact O-CD 3.5Š| ||
| 22 | T | 43.2 | Very low | 50.1 | Low | 112 Ų | 112 | 141.1 Ų | 141.1 | 69% | 0.687 | 76% | 0.756 | S | S | * | * | trans | -73.1 | 131.3 | 162.1 | 40.9 | 0 | 0 | 0 | 0 | 109.7 | F20 E24 | F20-T22 PolarHBondContact O-N 2.7Å; T22-E24 VanDerWaalsContact C-N 3.26Å; T22-E24 PolarHBondContact O-N 3.03Å | ||
| 23 | P | 48.3 | Very low | 49.8 | Very low | 134 Ų | 134 | 141.9 Ų | 141.9 | 87% | 0.87 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.4 | 52.2 | -164.4 | 34.9 | -38.9 | 0 | 0 | 0 | 114.3 | ||
| 24 | E | 47.9 | Very low | 49.2 | Very low | 179 Ų | 179 | 140.4 Ų | 140.4 | 84% | 0.836 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -146.8 | 6 | 171 | -92.2 | -106.5 | 123.8 | 0 | 0 | 113.2 | T22 L26 | T22-E24 VanDerWaalsContact C-N 3.26Å; T22-E24 PolarHBondContact O-N 3.03Å; E24-L26 VanDerWaalsContact C-N 3.27Å; E24-L26 PolarHBondContact O-N 3.09Å |
| 25 | S | 46.9 | Very low | 48.9 | Very low | 102 Ų | 102 | 138.2 Ų | 138.2 | 71% | 0.713 | 77% | 0.773 | S | S | * | * | trans | -78.9 | 63.1 | -173.5 | -160.6 | 0 | 0 | 0 | 0 | 114.3 | Y27 | S25-Y27 PolarHBondContact O-N 3.42Š| ||
| 26 | L | 54 | Low | 48.8 | Very low | 160 Ų | 160 | 140.2 Ų | 140.2 | 84% | 0.838 | 79% | 0.785 | S | S | * | * | trans | -78.2 | 60.6 | 173.1 | -72 | 176.7 | 0 | 0 | 0 | 112.2 | E24 | E24-L26 VanDerWaalsContact C-N 3.27Å; E24-L26 PolarHBondContact O-N 3.09Å | ||
| 27 | Y | 49.7 | Very low | 48.6 | Very low | 206 Ų | 206 | 144 Ų | 144 | 81% | 0.808 | 79% | 0.793 | S | S | * | * | trans | -135.7 | 125 | 172.3 | -127.3 | -96.7 | 0 | 0 | 0 | 113.2 | S25 S29 | S25-Y27 PolarHBondContact O-N 3.42Å; Y27-S29 VanDerWaalsContact C-N 3.3Å; Y27-S29 PolarHBondContact O-N 3.34Å | ||
| 28 | F | 46.7 | Very low | 48.5 | Very low | 188 Ų | 188 | 142.7 Ų | 142.7 | 83% | 0.825 | 79% | 0.786 | S | S | * | * | trans | -73.3 | 69.7 | -169.7 | -71.5 | -88.8 | 0 | 0 | 0 | 114.2 | N30 | F28-N30 PolarHBondContact O-N 3.04Š| ||
| 29 | S | 51.5 | Low | 48.3 | Very low | 104 Ų | 104 | 141.6 Ų | 141.6 | 73% | 0.727 | 79% | 0.789 | S | S | * | * | trans | -76.2 | 64.8 | 170.1 | -66.3 | 0 | 0 | 0 | 0 | 112.2 | Y27 | Y27-S29 VanDerWaalsContact C-N 3.3Å; Y27-S29 PolarHBondContact O-N 3.34Å | ||
| 30 | N | 45.3 | Very low | 48.7 | Very low | 156 Ų | 156 | 138.1 Ų | 138.1 | 83% | 0.834 | 79% | 0.79 | S | S | * | * | trans | 179 | 72.7 | 154.2 | -95.4 | -40.8 | 0 | 0 | 0 | 112.8 | F28 | F28-N30 PolarHBondContact O-N 3.04Š| ||
| 31 | L | 53.8 | Low | 49.4 | Very low | 162 Ų | 162 | 137.3 Ų | 137.3 | 85% | 0.848 | 79% | 0.792 | S | S | * | * | trans | -107.5 | 72.6 | 165.1 | -92.1 | 165.7 | 0 | 0 | 0 | 110.6 | G33 | L31-G33 PolarHBondContact O-N 3Š| ||
| 32 | R | 49.1 | Very low | 49.7 | Very low | 217 Ų | 217 | 140.9 Ų | 140.9 | 82% | 0.819 | 80% | 0.799 | S | S | * | * | trans | -75.2 | 114.1 | 165.5 | 179.2 | 175.5 | -69.8 | -102.7 | 0.6 | 108 | N34 | R32-N34 PolarHBondContact O-N 3.33Š| ||
| 33 | G | 46.3 | Very low | 49.9 | Very low | 76 Ų | 76 | 144.1 Ų | 144.1 | 78% | 0.784 | 81% | 0.806 | S | S | * | * | trans | -67.7 | 87.3 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | L31 | L31-G33 PolarHBondContact O-N 3Š| ||
| 34 | N | 43.9 | Very low | 50.2 | Low | 142 Ų | 142 | 144.7 Ų | 144.7 | 76% | 0.759 | 80% | 0.801 | S | S | * | * | trans | -139.5 | 123.7 | 159.2 | -92.1 | -21 | 0 | 0 | 0 | 107.3 | R32 A36 | R32-N34 PolarHBondContact O-N 3.33Å; N34-A36 VanDerWaalsContact C-N 3.27Å; N34-A36 PolarHBondContact O-N 3.26Å | ||
| 35 | G | 51.6 | Low | 50 | Low | 90 Ų | 90 | 141.6 Ų | 141.6 | 93% | 0.928 | 80% | 0.799 | S | S | * | * | trans | -76.8 | 60.6 | -169.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | H37 | G35-H37 PolarHBondContact O-N 3.31Š| ||
| 36 | A | 46.9 | Very low | 49.7 | Very low | 83 Ų | 83 | 145.5 Ų | 145.5 | 69% | 0.686 | 80% | 0.799 | S | S | * | * | trans | -78.4 | 105.5 | 168.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | N34 L38 | N34-A36 VanDerWaalsContact C-N 3.27Å; N34-A36 PolarHBondContact O-N 3.26Å; A36-L38 PolarHBondContact O-N 3.21Å | ||
| 37 | H | 52.2 | Low | 49.1 | Very low | 170 Ų | 170 | 144.6 Ų | 144.6 | 79% | 0.787 | 80% | 0.795 | S | S | * | * | trans | -74.5 | 93.5 | -179.5 | -179.7 | -79.9 | 0 | 0 | 0 | 111.2 | G35 S39 | G35-H37 PolarHBondContact O-N 3.31Å; H37-S39 PolarHBondContact O-N 3.41Å; H37-S39 VanDerWaalsContact O-N 3.12Å | ||
| 38 | L | 51.7 | Low | 48.8 | Very low | 148 Ų | 148 | 144.3 Ų | 144.3 | 78% | 0.775 | 79% | 0.793 | S | S | * | * | trans | -72.1 | 100.1 | 171.5 | -66.2 | 176.7 | 0 | 0 | 0 | 110.3 | A36 G40 | A36-L38 PolarHBondContact O-N 3.21Å; L38-G40 PolarHBondContact O-N 2.77Å | ||
| 39 | S | 50.7 | Low | 48.8 | Very low | 108 Ų | 108 | 145 Ų | 145 | 76% | 0.755 | 79% | 0.79 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.4 | 116.9 | 171 | 49.1 | 0 | 0 | 0 | 0 | 110.8 | H37 | H37-S39 PolarHBondContact O-N 3.41Å; H37-S39 VanDerWaalsContact O-N 3.12Å |
| 40 | G | 57.5 | Low | 48.4 | Very low | 80 Ų | 80 | 147.5 Ų | 147.5 | 83% | 0.825 | 79% | 0.79 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 145.2 | -12.2 | 171.7 | 0 | 0 | 0 | 0 | 0 | 116.7 | L38 | L38-G40 PolarHBondContact O-N 2.77Š|
| 41 | L | 56.8 | Low | 48.7 | Very low | 155 Ų | 155 | 145.4 Ų | 145.4 | 81% | 0.812 | 78% | 0.782 | S | S | * | * | trans | -95.7 | 133.2 | 176.6 | -69.1 | 177.1 | 0 | 0 | 0 | 112 | Q43 | L41-Q43 PolarHBondContact O-N 3.48Š| ||
| 42 | H | 49.4 | Very low | 48.5 | Very low | 187 Ų | 187 | 143.2 Ų | 143.2 | 87% | 0.866 | 78% | 0.78 | S | S | * | * | trans | -60 | 129.9 | 173.8 | -115.6 | -102.3 | 0 | 0 | 0 | 110.5 | I44 | H42-I44 PolarHBondContact O-N 2.88Å; H42-I44 VanDerWaalsContact O-N 3.08Å | ||
| 43 | Q | 48.9 | Very low | 48.6 | Very low | 179 Ų | 179 | 137.1 Ų | 137.1 | 84% | 0.836 | 77% | 0.77 | S | S | * | * | trans | -67.1 | 108.8 | 169 | -72.7 | -175.5 | -5.8 | 0 | 0 | 109.2 | L41 S45 | L41-Q43 PolarHBondContact O-N 3.48Å; Q43-S45 PolarHBondContact O-N 2.79Å; Q43-S45 VanDerWaalsContact O-N 3.08Å | ||
| 44 | I | 52.8 | Low | 48.9 | Very low | 147 Ų | 147 | 140.3 Ų | 140.3 | 75% | 0.754 | 77% | 0.768 | S | S | * | * | trans | -68.3 | 105.3 | 162.4 | -59.5 | 176.3 | 0 | 0 | 0 | 106.1 | H42 Y46 | H42-I44 PolarHBondContact O-N 2.88Å; H42-I44 VanDerWaalsContact O-N 3.08Å; I44-Y46 VanDerWaalsContact O-CD1 3.26Å; I44-Y46 WeakPolarHBondContact O-CD1 3.45Å; I44-Y46 PolarHBondContact O-N 3.4Å | ||
| 45 | S | 44.5 | Very low | 49.1 | Very low | 114 Ų | 114 | 138.7 Ų | 138.7 | 80% | 0.797 | 77% | 0.765 | S | S | * | * | trans | -72.4 | 70.9 | -176.6 | 45.1 | 0 | 0 | 0 | 0 | 111.7 | Q43 N47 | Q43-S45 PolarHBondContact O-N 2.79Å; Q43-S45 VanDerWaalsContact O-N 3.08Å; S45-N47 PolarHBondContact O-N 3.06Å; S45-N47 VanDerWaalsContact O-N 3.07Å | ||
| 46 | Y | 41.5 | Very low | 49.1 | Very low | 184 Ų | 184 | 145.9 Ų | 145.9 | 72% | 0.722 | 77% | 0.765 | S | S | * | * | trans | -58.2 | 116.2 | 167 | 46.4 | -100.1 | 0 | 0 | 0 | 108.8 | I44 R48 | I44-Y46 VanDerWaalsContact O-CD1 3.26Å; I44-Y46 WeakPolarHBondContact O-CD1 3.45Å; I44-Y46 PolarHBondContact O-N 3.4Å; Y46-R48 HydrophobicContact CD2-CB 4.25Å; Y46-R48 PolarHBondContact O-N 3.17Å | ||
| 47 | N | 40.7 | Very low | 49.1 | Very low | 140 Ų | 140 | 147.8 Ų | 147.8 | 75% | 0.749 | 77% | 0.768 | S | S | * | * | trans | -70.2 | 82.2 | 170 | -171.2 | -50.1 | 0 | 0 | 0 | 108.1 | S45 R49 | S45-N47 PolarHBondContact O-N 3.06Å; S45-N47 VanDerWaalsContact O-N 3.07Å; N47-R49 VanDerWaalsContact C-N 3.25Å; N47-R49 PolarHBondContact O-N 3.35Å | ||
| 48 | R | 44.1 | Very low | 48.3 | Very low | 201 Ų | 201 | 144 Ų | 144 | 76% | 0.758 | 76% | 0.761 | S | S | * | * | trans | -66.3 | 94 | 163.8 | 175 | -176.3 | -74.6 | -111.7 | 1.3 | 105.8 | Y46 E50 | Y46-R48 HydrophobicContact CD2-CB 4.25Å; Y46-R48 PolarHBondContact O-N 3.17Å; R48-E50 PolarHBondContact O-N 3.47Å | ||
| 49 | R | 46 | Very low | 48 | Very low | 203 Ų | 203 | 143.7 Ų | 143.7 | 77% | 0.766 | 77% | 0.768 | S | S | * | * | trans | -47.3 | 125.3 | 179.7 | -58.2 | 179.4 | -173.1 | -171.3 | 0.3 | 109.6 | N47 V51 | N47-R49 VanDerWaalsContact C-N 3.25Å; N47-R49 PolarHBondContact O-N 3.35Å; R49-V51 VanDerWaalsContact C-N 3.34Å; R49-V51 HydrophobicContact CB-CG2 4.27Å; R49-V51 PolarHBondContact O-N 3.37Å | ||
| 50 | E | 43.1 | Very low | 47.8 | Very low | 155 Ų | 155 | 143 Ų | 143 | 72% | 0.724 | 76% | 0.763 | S | S | * | * | trans | -64.7 | 90.8 | 178.7 | -73.8 | -64.1 | 164.3 | 0 | 0 | 110.4 | R48 S53 | R48-E50 PolarHBondContact O-N 3.47Å; E50-S53 WeakPolarHBondContact OE2-CB 3.16Å; E50-S53 PolarHBondContact OE2-OG 3.11Å | ||
| 51 | V | 51 | Low | 46.7 | Very low | 112 Ų | 112 | 144.9 Ų | 144.9 | 68% | 0.679 | 76% | 0.763 | S | S | * | * | trans | -134.1 | 114 | 177.6 | -175.2 | 0 | 0 | 0 | 0 | 107.5 | R49 | R49-V51 VanDerWaalsContact C-N 3.34Å; R49-V51 HydrophobicContact CB-CG2 4.27Å; R49-V51 PolarHBondContact O-N 3.37Å | ||
| 52 | C | 50.8 | Low | 46.3 | Very low | 117 Ų | 117 | 143.4 Ų | 143.4 | 79% | 0.791 | 77% | 0.765 | S | S | * | * | S | Bend | trans | 69.9 | 37.6 | 179.4 | -56.9 | 0 | 0 | 0 | 0 | 116.8 | L54 | C52-L54 PolarHBondContact O-N 2.93Š|
| 53 | S | 50.7 | Low | 45.9 | Very low | 88 Ų | 88 | 141 Ų | 141 | 62% | 0.615 | 76% | 0.763 | S | S | * | * | trans | -81.3 | 25.4 | 160.1 | -53 | 0 | 0 | 0 | 0 | 113.1 | E50 | E50-S53 WeakPolarHBondContact OE2-CB 3.16Å; E50-S53 PolarHBondContact OE2-OG 3.11Å | ||
| 54 | L | 52.2 | Low | 45.7 | Very low | 143 Ų | 143 | 138.1 Ų | 138.1 | 75% | 0.749 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -110.7 | 135.3 | 177.9 | -76.4 | 85.3 | 0 | 0 | 0 | 110.8 | C52 | C52-L54 PolarHBondContact O-N 2.93Š|
| 55 | P | 47.7 | Very low | 45.5 | Very low | 108 Ų | 108 | 136.6 Ų | 136.6 | 70% | 0.701 | 76% | 0.763 | S | S | * | * | trans | -66.7 | 142.1 | 169.9 | 29.8 | -34.1 | 0 | 0 | 0 | 110.4 | T57 | P55-T57 PolarHBondContact O-N 3.36Š| ||
| 56 | W | 52.3 | Low | 45.9 | Very low | 242 Ų | 242 | 137.5 Ų | 137.5 | 92% | 0.917 | 77% | 0.765 | S | S | * | * | trans | -69.1 | 94.4 | 171.1 | -93.1 | 39.3 | 0 | 0 | 0 | 110.4 | S58 | W56-S58 PolarHBondContact O-N 3.08Š| ||
| 57 | T | 47 | Very low | 46.3 | Very low | 122 Ų | 122 | 137.8 Ų | 137.8 | 75% | 0.748 | 77% | 0.774 | S | S | * | * | trans | -78.7 | 98.6 | 168.1 | 55.2 | 0 | 0 | 0 | 0 | 109.7 | P55 | P55-T57 PolarHBondContact O-N 3.36Š| ||
| 58 | S | 35.9 | Very low | 46.4 | Very low | 91 Ų | 91 | 137 Ų | 137 | 64% | 0.636 | 78% | 0.779 | S | S | * | * | trans | -57.3 | 129.3 | 174.6 | -60.8 | 0 | 0 | 0 | 0 | 111.4 | W56 S60 | W56-S58 PolarHBondContact O-N 3.08Å; S58-S60 VanDerWaalsContact C-N 3.33Å; S58-S60 PolarHBondContact O-N 3.2Å | ||
| 59 | P | 45.2 | Very low | 46.4 | Very low | 142 Ų | 142 | 139.2 Ų | 139.2 | 92% | 0.922 | 79% | 0.787 | S | S | * | * | trans | -78.8 | 79.8 | 179.1 | 32.1 | -34.9 | 0 | 0 | 0 | 110.8 | ||||
| 60 | S | 46 | Very low | 46.2 | Very low | 94 Ų | 94 | 133.9 Ų | 133.9 | 66% | 0.657 | 79% | 0.786 | S | S | * | * | trans | -146.7 | 75.1 | 178.6 | 63.8 | 0 | 0 | 0 | 0 | 113.1 | S58 | S58-S60 VanDerWaalsContact C-N 3.33Å; S58-S60 PolarHBondContact O-N 3.2Å | ||
| 61 | S | 34.9 | Very low | 46.1 | Very low | 119 Ų | 119 | 136 Ų | 136 | 83% | 0.832 | 79% | 0.794 | S | S | * | * | trans | -167.1 | 146.8 | 142.3 | -107.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 62 | C | 48.5 | Very low | 45.5 | Very low | 124 Ų | 124 | 135.6 Ų | 135.6 | 84% | 0.838 | 80% | 0.796 | S | S | * | * | trans | -79.4 | 138.3 | 176.2 | 44.8 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 63 | T | 39.5 | Very low | 45.1 | Very low | 137 Ų | 137 | 133.2 Ų | 133.2 | 84% | 0.84 | 79% | 0.791 | S | S | * | * | trans | -150.1 | 118.5 | 164.2 | -59.5 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 64 | S | 45.3 | Very low | 44.8 | Very low | 118 Ų | 118 | 140 Ų | 140 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | trans | -108.1 | 122.9 | -178.6 | 53.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 65 | P | 48.1 | Very low | 44.7 | Very low | 115 Ų | 115 | 138.7 Ų | 138.7 | 75% | 0.747 | 81% | 0.807 | S | S | * | * | trans | -106.1 | 172.7 | 162.8 | 37.2 | -26.6 | 0 | 0 | 0 | 111 | ||||
| 66 | P | 52.5 | Low | 45.4 | Very low | 132 Ų | 132 | 139 Ų | 139 | 86% | 0.857 | 81% | 0.81 | S | S | * | * | -107.4 | 176.6 | -124.1 | 4.4 | 18.5 | 0 | 0 | 0 | 116.9 | |||||
| 67 | Q | 50.8 | Low | 45.6 | Very low | 191 Ų | 191 | 133.4 Ų | 133.4 | 89% | 0.893 | 80% | 0.804 | S | S | * | * | trans | -71 | 140.8 | 176.9 | -59.7 | 176.2 | -8 | 0 | 0 | 113.5 | ||||
| 68 | S | 42.4 | Very low | 45.5 | Very low | 124 Ų | 124 | 137 Ų | 137 | 87% | 0.867 | 81% | 0.81 | S | S | * | * | trans | -149.3 | 148.2 | 149.1 | -82 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 69 | R | 45.3 | Very low | 46.1 | Very low | 247 Ų | 247 | 141.1 Ų | 141.1 | 93% | 0.932 | 82% | 0.824 | S | S | * | * | trans | -78.1 | 170.7 | -177.3 | -48.9 | 171.5 | -175.1 | -175.7 | -0.6 | 109.8 | ||||
| 70 | A | 40.2 | Very low | 45.8 | Very low | 90 Ų | 90 | 139 Ų | 139 | 74% | 0.744 | 81% | 0.813 | S | S | * | * | cis | -170 | 165.9 | 27 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 71 | F | 41.5 | Very low | 45.2 | Very low | 201 Ų | 201 | 142.4 Ų | 142.4 | 88% | 0.882 | 82% | 0.823 | S | S | * | * | trans | 62.1 | 151.9 | 143.6 | -134.6 | -101.4 | 0 | 0 | 0 | 121.8 | ||||
| 72 | S | 38.7 | Very low | 45.5 | Very low | 102 Ų | 102 | 142 Ų | 142 | 71% | 0.713 | 82% | 0.82 | S | S | * | * | trans | 56.2 | 123 | 179.7 | -63.3 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 73 | G | 41.7 | Very low | 45.4 | Very low | 67 Ų | 67 | 143 Ų | 143 | 69% | 0.691 | 82% | 0.822 | S | S | * | * | cis | 101.4 | 83 | 2.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 74 | Y | 44.1 | Very low | 46.2 | Very low | 231 Ų | 231 | 141.7 Ų | 141.7 | 91% | 0.906 | 82% | 0.816 | S | S | * | * | trans | -153.3 | 135.4 | 159 | -96.9 | -71.6 | 0 | 0 | 0 | 109.7 | ||||
| 75 | S | 50.7 | Low | 46.1 | Very low | 115 Ų | 115 | 142.9 Ų | 142.9 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | trans | -106.8 | 135.6 | 178.5 | -54.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 76 | P | 63.3 | Low | 45.5 | Very low | 116 Ų | 116 | 144.4 Ų | 144.4 | 75% | 0.753 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 154.7 | 155.6 | 33.2 | -31.3 | 0 | 0 | 0 | 110.5 | ||
| 77 | P | 56.8 | Low | 45.2 | Very low | 124 Ų | 124 | 143.4 Ų | 143.4 | 81% | 0.805 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -82.8 | 162.9 | -168.8 | 32.8 | -36.8 | 0 | 0 | 0 | 114.8 | ||
| 78 | F | 43.2 | Very low | 44.6 | Very low | 197 Ų | 197 | 141.9 Ų | 141.9 | 86% | 0.864 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 143.1 | 175.3 | -64.5 | -99.3 | 0 | 0 | 0 | 113.2 | ||
| 79 | L | 48.9 | Very low | 45.2 | Very low | 177 Ų | 177 | 141.2 Ų | 141.2 | 93% | 0.927 | 80% | 0.803 | S | S | * | * | trans | -130.4 | 136.2 | 136.7 | -78.2 | 179.5 | 0 | 0 | 0 | 108.8 | ||||
| 80 | S | 39.6 | Very low | 44.8 | Very low | 98 Ų | 98 | 136 Ų | 136 | 69% | 0.685 | 79% | 0.793 | S | S | * | * | trans | -76.4 | 143.4 | -175.5 | -57.6 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 81 | N | 34 | Very low | 44.6 | Very low | 165 Ų | 165 | 137 Ų | 137 | 88% | 0.882 | 79% | 0.786 | S | S | * | * | -164 | 136.1 | 109.1 | -95.4 | -17 | 0 | 0 | 0 | 111.3 | |||||
| 82 | S | 40.5 | Very low | 45 | Very low | 110 Ų | 110 | 135.9 Ų | 135.9 | 77% | 0.769 | 78% | 0.783 | S | S | * | * | trans | -120.2 | 125.2 | -170.7 | -56.7 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 83 | V | 47.3 | Very low | 45.2 | Very low | 145 Ų | 145 | 137.6 Ų | 137.6 | 88% | 0.879 | 78% | 0.784 | S | S | * | * | trans | -140.8 | 112.3 | 149.2 | -173.3 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 84 | P | 55.1 | Low | 45.2 | Very low | 110 Ų | 110 | 144.6 Ų | 144.6 | 71% | 0.714 | 80% | 0.796 | S | S | * | * | trans | -85.8 | 140.3 | 176.4 | 32.9 | -32.3 | 0 | 0 | 0 | 111.6 | ||||
| 85 | V | 44.1 | Very low | 44.8 | Very low | 144 Ų | 144 | 137.1 Ų | 137.1 | 87% | 0.873 | 79% | 0.789 | S | S | * | * | trans | -73.7 | 128.4 | 154.1 | 172 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 86 | N | 35.4 | Very low | 45 | Very low | 147 Ų | 147 | 137.5 Ų | 137.5 | 79% | 0.786 | 79% | 0.789 | S | S | * | * | trans | -135.2 | 135.1 | 172.6 | -168.3 | 12.4 | 0 | 0 | 0 | 111 | ||||
| 87 | T | 45.7 | Very low | 43.7 | Very low | 111 Ų | 111 | 139.6 Ų | 139.6 | 68% | 0.681 | 79% | 0.793 | S | S | * | * | trans | -114.8 | 122.3 | -178 | 49.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 88 | N | 38.1 | Very low | 42.8 | Very low | 158 Ų | 158 | 140.1 Ų | 140.1 | 85% | 0.845 | 79% | 0.789 | S | S | * | * | trans | -166.7 | 169.3 | 151.2 | -110.5 | -10.5 | 0 | 0 | 0 | 111.5 | ||||
| 89 | P | 55.5 | Low | 42.5 | Very low | 111 Ų | 111 | 138.2 Ų | 138.2 | 72% | 0.721 | 78% | 0.782 | S | S | * | * | trans | -135.5 | -165.8 | -134.1 | 40.2 | -19.5 | 0 | 0 | 0 | 115.1 | ||||
| 90 | N | 35.9 | Very low | 42 | Very low | 136 Ų | 136 | 132.9 Ų | 132.9 | 73% | 0.727 | 76% | 0.76 | S | S | * | * | trans | 105 | 134.3 | 144.4 | -154 | 16.4 | 0 | 0 | 0 | 118.3 | ||||
| 91 | N | 36.2 | Very low | 42 | Very low | 113 Ų | 113 | 136.5 Ų | 136.5 | 60% | 0.604 | 77% | 0.772 | S | S | * | * | trans | 47.6 | 127.8 | 166 | -76.3 | -37.7 | 0 | 0 | 0 | 119.4 | ||||
| 92 | H | 49.8 | Very low | 42.3 | Very low | 177 Ų | 177 | 137 Ų | 137 | 82% | 0.819 | 77% | 0.766 | S | S | * | * | -155.6 | 159.8 | 65.4 | -104.6 | -90.9 | 0 | 0 | 0 | 114.9 | |||||
| 93 | N | 42.6 | Very low | 42 | Very low | 138 Ų | 138 | 141.8 Ų | 141.8 | 74% | 0.738 | 77% | 0.769 | S | S | * | * | trans | -62.3 | 145.6 | 173.4 | -65.9 | -81.6 | 0 | 0 | 0 | 113.8 | ||||
| 94 | K | 43.2 | Very low | 41.8 | Very low | 214 Ų | 214 | 146 Ų | 146 | 93% | 0.93 | 77% | 0.771 | S | S | * | * | -157.4 | 166.2 | 114.2 | -74.7 | -142.3 | -178.5 | 178.3 | 0 | 110.7 | |||||
| 95 | G | 34.2 | Very low | 40.8 | Very low | 74 Ų | 74 | 149 Ų | 149 | 76% | 0.763 | 77% | 0.773 | S | S | * | * | trans | -96.3 | -155.9 | -166.1 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 96 | P | 54.8 | Low | 40.5 | Very low | 123 Ų | 123 | 150.4 Ų | 150.4 | 80% | 0.799 | 77% | 0.77 | S | S | * | * | trans | -114.4 | 160.7 | -146 | 41 | -34.9 | 0 | 0 | 0 | 116.4 | ||||
| 97 | L | 37.4 | Very low | 40.6 | Very low | 159 Ų | 159 | 150.9 Ų | 150.9 | 83% | 0.832 | 77% | 0.772 | S | S | * | * | trans | -165.3 | 144.9 | 130.6 | -137.1 | 75.7 | 0 | 0 | 0 | 114.2 | ||||
| 98 | D | 37.8 | Very low | 40.5 | Very low | 135 Ų | 135 | 151.3 Ų | 151.3 | 72% | 0.722 | 78% | 0.775 | S | S | * | * | trans | 55.4 | 149.5 | 142.3 | -109.1 | -45.6 | 0 | 0 | 0 | 129.2 | ||||
| 99 | E | 37.2 | Very low | 40.6 | Very low | 157 Ų | 157 | 150.1 Ų | 150.1 | 73% | 0.734 | 77% | 0.768 | S | S | * | * | trans | 95.3 | 138.7 | 134.8 | -103.7 | -150 | 82.8 | 0 | 0 | 127.2 | ||||
| 100 | S | 38 | Very low | 40 | Very low | 66 Ų | 66 | 153.6 Ų | 153.6 | 46% | 0.462 | 77% | 0.774 | S | S | . | * | trans | 68.4 | 84.5 | 147.5 | -96.2 | 0 | 0 | 0 | 0 | 120.6 | K102 | S100-K102 PolarHBondContact O-N 2.81Š| ||
| 101 | N | 39.7 | Very low | 40.2 | Very low | 173 Ų | 173 | 155.8 Ų | 155.8 | 93% | 0.925 | 78% | 0.778 | S | S | * | * | trans | -49.9 | 121.1 | 145.2 | -94.9 | -38.9 | 0 | 0 | 0 | 110.9 | ||||
| 102 | K | 40.5 | Very low | 40.8 | Very low | 177 Ų | 177 | 155.6 Ų | 155.6 | 77% | 0.77 | 78% | 0.782 | S | S | * | * | trans | -134.3 | 133.3 | 162.4 | -69 | -173 | -178.4 | 170.2 | 0 | 112.3 | S100 | S100-K102 PolarHBondContact O-N 2.81Š| ||
| 103 | Y | 33 | Very low | 40 | Very low | 209 Ų | 209 | 156 Ų | 156 | 82% | 0.82 | 79% | 0.785 | S | S | * | * | trans | -37.4 | 138.6 | 178.9 | -81.8 | -112.5 | 0 | 0 | 0 | 115.3 | F105 | Y103-F105 HydrophobicContact CD1-CD2 4.09Å; Y103-F105 HydrophobicContact CD1-CE2 4.22Å; Y103-F105 HydrophobicContact CE1-CE2 4.47Å | ||
| 104 | Y | 43 | Very low | 39.6 | Very low | 235 Ų | 235 | 157 Ų | 157 | 92% | 0.922 | 79% | 0.785 | S | S | * | * | trans | -92.5 | 123.6 | 145 | -106.2 | -89.9 | 0 | 0 | 0 | 108.7 | ||||
| 105 | F | 35.8 | Very low | 39.9 | Very low | 173 Ų | 173 | 152.6 Ų | 152.6 | 76% | 0.759 | 78% | 0.778 | S | S | * | * | trans | -95.6 | 162.9 | 165.1 | -123.4 | -94.4 | 0 | 0 | 0 | 109.6 | Y103 | Y103-F105 HydrophobicContact CD1-CD2 4.09Å; Y103-F105 HydrophobicContact CD1-CE2 4.22Å; Y103-F105 HydrophobicContact CE1-CE2 4.47Å | ||
| 106 | Q | 37.6 | Very low | 40 | Very low | 173 Ų | 173 | 152 Ų | 152 | 81% | 0.808 | 77% | 0.766 | S | S | * | * | trans | -117.7 | 117.8 | -177 | -177.1 | 159.1 | 6.5 | 0 | 0 | 110.8 | ||||
| 107 | D | 37.5 | Very low | 39.1 | Very low | 156 Ų | 156 | 157.3 Ų | 157.3 | 83% | 0.834 | 77% | 0.77 | S | S | * | * | trans | -100.3 | 163.4 | 177.3 | -93.2 | -59.8 | 0 | 0 | 0 | 113 | ||||
| 108 | V | 42.4 | Very low | 39 | Very low | 121 Ų | 121 | 157.9 Ų | 157.9 | 73% | 0.733 | 77% | 0.768 | S | S | * | * | trans | -134.5 | 147.2 | -155.5 | -151.7 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 109 | N | 40.6 | Very low | 38.9 | Very low | 133 Ų | 133 | 155.5 Ų | 155.5 | 71% | 0.711 | 77% | 0.767 | S | S | * | * | trans | 73.5 | 142.7 | 155.3 | -158.3 | 8.5 | 0 | 0 | 0 | 117.1 | ||||
| 110 | H | 42.1 | Very low | 38.7 | Very low | 183 Ų | 183 | 157.4 Ų | 157.4 | 85% | 0.847 | 78% | 0.776 | S | S | * | * | -169.6 | 127.1 | 123.8 | -99.8 | 85.8 | 0 | 0 | 0 | 109.3 | |||||
| 111 | K | 41.4 | Very low | 38.6 | Very low | 183 Ų | 183 | 158.4 Ų | 158.4 | 80% | 0.796 | 79% | 0.788 | S | S | * | * | trans | -98.5 | 140.9 | 167.5 | -131.5 | -174.5 | 180 | -167.9 | 0 | 107.6 | ||||
| 112 | P | 47.3 | Very low | 38.2 | Very low | 109 Ų | 109 | 160.3 Ų | 160.3 | 71% | 0.708 | 79% | 0.789 | S | S | * | * | -148.5 | 175.1 | 99.8 | 36.5 | -18.7 | 0 | 0 | 0 | 113.6 | |||||
| 113 | E | 34 | Very low | 38 | Very low | 185 Ų | 185 | 157.2 Ų | 157.2 | 86% | 0.864 | 79% | 0.789 | S | S | * | * | cis | -155.7 | -142.9 | -26.8 | -107 | 179.6 | 116 | 0 | 0 | 108.7 | ||||
| 114 | E | 35.1 | Very low | 37.9 | Very low | 159 Ų | 159 | 150.5 Ų | 150.5 | 74% | 0.743 | 78% | 0.784 | S | S | * | * | trans | -129.4 | 165.8 | 178.2 | -134.9 | -120.1 | 164.1 | 0 | 0 | 110 | A116 | E114-A116 PolarHBondContact OE1-N 2.98Å; E114-A116 PolarHBondContact OE2-N 3.44Å | ||
| 115 | P | 48.3 | Very low | 37.5 | Very low | 121 Ų | 121 | 146.6 Ų | 146.6 | 79% | 0.786 | 77% | 0.774 | S | S | * | * | -156.6 | 124.2 | 98.2 | 36.8 | -15.3 | 0 | 0 | 0 | 118.6 | |||||
| 116 | A | 36.1 | Very low | 37.8 | Very low | 61 Ų | 61 | 146.7 Ų | 146.7 | 50% | 0.504 | 78% | 0.776 | S | S | . | * | 73.5 | 155.1 | 121.2 | 0 | 0 | 0 | 0 | 0 | 123.8 | E114 | E114-A116 PolarHBondContact OE1-N 2.98Å; E114-A116 PolarHBondContact OE2-N 3.44Å | |||
| 117 | R | 35.5 | Very low | 37.6 | Very low | 235 Ų | 235 | 142.3 Ų | 142.3 | 89% | 0.887 | 78% | 0.777 | S | S | * | * | trans | 82.8 | 142.9 | 172.2 | -48.8 | -176.6 | -169.2 | -165.9 | 3.1 | 114.5 | ||||
| 118 | H | 36.2 | Very low | 37.6 | Very low | 172 Ų | 172 | 141.3 Ų | 141.3 | 80% | 0.796 | 78% | 0.777 | S | S | * | * | cis | -131.7 | 149 | 14.5 | -142.8 | -81.3 | 0 | 0 | 0 | 112.2 | ||||
| 119 | A | 34.8 | Very low | 37.2 | Very low | 85 Ų | 85 | 143.1 Ų | 143.1 | 70% | 0.702 | 78% | 0.781 | S | S | * | * | trans | -107 | 154.4 | 169.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 120 | Q | 34.6 | Very low | 36.9 | Very low | 197 Ų | 197 | 144.3 Ų | 144.3 | 92% | 0.921 | 79% | 0.787 | S | S | * | * | trans | -141.8 | 142.4 | 153.7 | -103.2 | -173 | -23.2 | 0 | 0 | 108.1 | ||||
| 121 | A | 35.4 | Very low | 36.7 | Very low | 87 Ų | 87 | 145.6 Ų | 145.6 | 72% | 0.719 | 79% | 0.791 | S | S | * | * | trans | -133.4 | 155.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 122 | F | 31 | Very low | 36.2 | Very low | 212 Ų | 212 | 140 Ų | 140 | 93% | 0.93 | 79% | 0.786 | S | S | * | * | trans | -145.9 | 158.9 | 148.5 | -125.3 | -85.6 | 0 | 0 | 0 | 109.8 | ||||
| 123 | S | 36.5 | Very low | 35.6 | Very low | 112 Ų | 112 | 140.7 Ų | 140.7 | 78% | 0.783 | 79% | 0.793 | S | S | * | * | trans | -116.4 | 162.3 | -144.5 | -48.6 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 124 | G | 31.6 | Very low | 36.1 | Very low | 68 Ų | 68 | 137.2 Ų | 137.2 | 70% | 0.701 | 79% | 0.789 | S | S | * | * | trans | 128.2 | 143.3 | 146.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 125 | E | 34.3 | Very low | 36 | Very low | 153 Ų | 153 | 139 Ų | 139 | 72% | 0.715 | 79% | 0.794 | S | S | * | * | cis | -165.8 | 168.2 | -16.3 | -121.3 | -57 | 155.2 | 0 | 0 | 107.5 | ||||
| 126 | H | 40.6 | Very low | 35.4 | Very low | 175 Ų | 175 | 143.1 Ų | 143.1 | 81% | 0.81 | 80% | 0.795 | S | S | * | * | trans | 68.6 | 140.3 | 163.2 | -52 | -25 | 0 | 0 | 0 | 118.8 | ||||
| 127 | G | 33.7 | Very low | 35.2 | Very low | 81 Ų | 81 | 148.7 Ų | 148.7 | 84% | 0.835 | 81% | 0.811 | S | S | * | * | trans | 135.5 | 85.2 | 165.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 128 | V | 37.1 | Very low | 35 | Very low | 135 Ų | 135 | 146.1 Ų | 146.1 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | trans | -100.9 | 165.7 | -179.8 | -77.6 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 129 | I | 35.5 | Very low | 35 | Very low | 159 Ų | 159 | 142.8 Ų | 142.8 | 82% | 0.815 | 80% | 0.802 | S | S | * | * | trans | 69.4 | 102.7 | 159 | 55.1 | 169.1 | 0 | 0 | 0 | 122.3 | ||||
| 130 | N | 33.1 | Very low | 35.3 | Very low | 159 Ų | 159 | 145.5 Ų | 145.5 | 85% | 0.85 | 81% | 0.805 | S | S | * | * | 98.4 | 165.3 | 112.6 | -154.4 | 23.8 | 0 | 0 | 0 | 120.5 | |||||
| 131 | F | 38.8 | Very low | 35.5 | Very low | 209 Ų | 209 | 143.5 Ų | 143.5 | 92% | 0.917 | 80% | 0.8 | S | S | * | * | trans | -92 | 147.2 | -161.1 | -133.1 | -104.3 | 0 | 0 | 0 | 114.2 | ||||
| 132 | G | 29.6 | Very low | 35.5 | Very low | 67 Ų | 67 | 146.3 Ų | 146.3 | 69% | 0.691 | 80% | 0.803 | S | S | * | * | trans | 152.7 | 116.9 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 133 | S | 35.9 | Very low | 35.8 | Very low | 123 Ų | 123 | 147.1 Ų | 147.1 | 86% | 0.86 | 80% | 0.8 | S | S | * | * | 80 | 98 | 53.1 | -160.8 | 0 | 0 | 0 | 0 | 115 | |||||
| 134 | S | 44 | Very low | 35.4 | Very low | 111 Ų | 111 | 151.9 Ų | 151.9 | 78% | 0.776 | 80% | 0.801 | S | S | * | * | trans | 41.5 | 113 | 146.6 | -160.5 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 135 | K | 33.5 | Very low | 35.7 | Very low | 198 Ų | 198 | 152.8 Ų | 152.8 | 86% | 0.861 | 80% | 0.797 | S | S | * | * | trans | -156.6 | 157.7 | 138.7 | -54.9 | -171.7 | -178.7 | 175.8 | 0 | 106.4 | ||||
| 136 | Y | 35.9 | Very low | 36 | Very low | 206 Ų | 206 | 153.3 Ų | 153.3 | 81% | 0.808 | 80% | 0.799 | S | S | * | * | cis | -150.6 | 161.3 | -7.5 | 42.4 | -101.7 | 0 | 0 | 0 | 106 | ||||
| 137 | E | 31.3 | Very low | 35.9 | Very low | 179 Ų | 179 | 151.7 Ų | 151.7 | 84% | 0.836 | 80% | 0.796 | S | S | * | * | cis | 99.9 | 142.7 | 15 | -160.1 | 168.5 | -162.1 | 0 | 0 | 116 | ||||
| 138 | F | 31.1 | Very low | 36.2 | Very low | 180 Ų | 180 | 153.8 Ų | 153.8 | 79% | 0.789 | 80% | 0.798 | S | S | * | * | trans | 73.1 | 135.2 | -174.8 | -129.8 | -114.1 | 0 | 0 | 0 | 116.6 | ||||
| 139 | S | 36.6 | Very low | 35.9 | Very low | 102 Ų | 102 | 150.5 Ų | 150.5 | 71% | 0.713 | 79% | 0.791 | S | S | * | * | cis | -134.2 | 158.7 | 30.4 | -49.4 | 0 | 0 | 0 | 0 | 115 | ||||
| 140 | N | 40.3 | Very low | 35.8 | Very low | 143 Ų | 143 | 147.8 Ų | 147.8 | 77% | 0.765 | 79% | 0.792 | S | S | * | * | trans | -131.9 | 120.6 | 175 | -108.4 | -59.9 | 0 | 0 | 0 | 111.5 | ||||
| 141 | L | 40.1 | Very low | 36 | Very low | 155 Ų | 155 | 148.6 Ų | 148.6 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | trans | -146.7 | 144.4 | 157.7 | -69.8 | 177.6 | 0 | 0 | 0 | 105.9 | ||||
| 142 | D | 34.4 | Very low | 35.8 | Very low | 145 Ų | 145 | 147 Ų | 147 | 78% | 0.775 | 79% | 0.786 | S | S | * | * | cis | -141.2 | 167.2 | 16.3 | -130.2 | -43.7 | 0 | 0 | 0 | 113.7 | ||||
| 143 | R | 38.3 | Very low | 36 | Very low | 230 Ų | 230 | 150.1 Ų | 150.1 | 87% | 0.868 | 78% | 0.783 | S | S | * | * | trans | -115.8 | 125.5 | -177.9 | -150.3 | -171.6 | -169.5 | -160.6 | 5.2 | 109.9 | ||||
| 144 | R | 28.7 | Very low | 36.1 | Very low | 211 Ų | 211 | 150.9 Ų | 150.9 | 80% | 0.796 | 78% | 0.777 | S | S | * | * | trans | -135.5 | 110.3 | 156.2 | -163.2 | 70.7 | -170.3 | -135.4 | 0.7 | 112.3 | H146 | R144-H146 PolarHBondContact NE-NE2 3.06Å; R144-H146 PolarHBondContact NH2-NE2 3.3Å | ||
| 145 | S | 36.3 | Very low | 35.9 | Very low | 88 Ų | 88 | 152.4 Ų | 152.4 | 62% | 0.615 | 78% | 0.776 | S | S | * | * | trans | -92 | 147.1 | 166.5 | 177.7 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 146 | H | 42.3 | Very low | 36.8 | Very low | 164 Ų | 164 | 148.3 Ų | 148.3 | 76% | 0.759 | 77% | 0.769 | S | S | * | * | trans | -138.6 | 140.7 | 147.5 | -92.5 | -75.2 | 0 | 0 | 0 | 108.5 | R144 | R144-H146 PolarHBondContact NE-NE2 3.06Å; R144-H146 PolarHBondContact NH2-NE2 3.3Å | ||
| 147 | N | 37.6 | Very low | 37 | Very low | 140 Ų | 140 | 143.4 Ų | 143.4 | 75% | 0.749 | 76% | 0.761 | S | S | * | * | trans | -130.1 | 128.8 | -170.5 | 171.3 | 51.7 | 0 | 0 | 0 | 110.2 | ||||
| 148 | S | 39.7 | Very low | 37.2 | Very low | 125 Ų | 125 | 142.6 Ų | 142.6 | 87% | 0.874 | 76% | 0.762 | S | S | * | * | trans | -166.8 | 142.4 | 164.6 | -77.6 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 149 | G | 30.8 | Very low | 37.5 | Very low | 66 Ų | 66 | 142 Ų | 142 | 68% | 0.68 | 76% | 0.762 | S | S | * | * | cis | 157.2 | 137 | -5.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 150 | A | 34.6 | Very low | 37.4 | Very low | 102 Ų | 102 | 141.3 Ų | 141.3 | 84% | 0.843 | 76% | 0.763 | S | S | * | * | trans | 65.3 | 164.1 | 179.7 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 151 | Q | 35.6 | Very low | 37.1 | Very low | 177 Ų | 177 | 139.9 Ų | 139.9 | 83% | 0.827 | 76% | 0.764 | S | S | * | * | -174.7 | 179.2 | -55.6 | -116.8 | -177.8 | -23 | 0 | 0 | 109.2 | |||||
| 152 | H | 36 | Very low | 36.9 | Very low | 174 Ų | 174 | 137.3 Ų | 137.3 | 81% | 0.806 | 77% | 0.765 | S | S | * | * | trans | 68.7 | 151.3 | 172.8 | -95.8 | -117.1 | 0 | 0 | 0 | 116.9 | ||||
| 153 | E | 33.3 | Very low | 36.8 | Very low | 133 Ų | 133 | 135.3 Ų | 135.3 | 62% | 0.621 | 77% | 0.769 | S | S | * | * | cis | -174.8 | 162.2 | -34.5 | -116.7 | -90.7 | 73.5 | 0 | 0 | 109 | ||||
| 154 | L | 37.4 | Very low | 36.5 | Very low | 140 Ų | 140 | 127.7 Ų | 127.7 | 73% | 0.733 | 76% | 0.762 | S | S | * | * | trans | 47 | 131 | 164.7 | -57.5 | 180 | 0 | 0 | 0 | 122 | ||||
| 155 | N | 40.7 | Very low | 36.7 | Very low | 142 Ų | 142 | 126.8 Ų | 126.8 | 76% | 0.759 | 76% | 0.764 | S | S | * | * | trans | -96.9 | 140.4 | 151.1 | 170.5 | 23.6 | 0 | 0 | 0 | 108.5 | ||||
| 156 | P | 51.2 | Low | 36.7 | Very low | 112 Ų | 112 | 130.1 Ų | 130.1 | 73% | 0.727 | 77% | 0.767 | S | S | * | * | trans | -139.9 | 142.4 | 132.4 | 35.9 | -22.9 | 0 | 0 | 0 | 116.4 | ||||
| 157 | T | 39.8 | Very low | 36.2 | Very low | 104 Ų | 104 | 130.7 Ų | 130.7 | 64% | 0.638 | 77% | 0.77 | S | S | * | * | trans | -31.9 | 138.1 | 159.3 | -57.2 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 158 | N | 35.8 | Very low | 35.9 | Very low | 161 Ų | 161 | 129.5 Ų | 129.5 | 86% | 0.861 | 77% | 0.773 | S | S | * | * | -158.4 | 170.5 | 129.9 | -110.9 | -43.8 | 0 | 0 | 0 | 114.6 | |||||
| 159 | Q | 38.3 | Very low | 35.7 | Very low | 169 Ų | 169 | 127.4 Ų | 127.4 | 79% | 0.79 | 76% | 0.763 | S | S | * | * | trans | -110.7 | 179 | -161.7 | -55.5 | 178.7 | -0.7 | 0 | 0 | 114.4 | ||||
| 160 | A | 34.6 | Very low | 35.9 | Very low | 87 Ų | 87 | 133.9 Ų | 133.9 | 72% | 0.719 | 78% | 0.775 | S | S | * | * | trans | 76.5 | 153.1 | 152.9 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 161 | S | 33.3 | Very low | 36.1 | Very low | 112 Ų | 112 | 134 Ų | 134 | 78% | 0.783 | 77% | 0.771 | S | S | * | * | cis | -169 | 170.6 | -19.8 | -101.4 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 162 | A | 35.2 | Very low | 36.3 | Very low | 102 Ų | 102 | 133.1 Ų | 133.1 | 84% | 0.843 | 77% | 0.769 | S | S | * | * | trans | 66.6 | 166.2 | 166 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 163 | A | 33.4 | Very low | 36.6 | Very low | 103 Ų | 103 | 130.3 Ų | 130.3 | 85% | 0.851 | 77% | 0.767 | S | S | * | * | cis | -172.7 | 169.8 | -37.7 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 164 | G | 30.9 | Very low | 37 | Very low | 70 Ų | 70 | 130.3 Ų | 130.3 | 72% | 0.722 | 78% | 0.776 | S | S | * | * | trans | 118.1 | 77.4 | 157.3 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 165 | F | 33.6 | Very low | 37.5 | Very low | 192 Ų | 192 | 131 Ų | 131 | 84% | 0.842 | 78% | 0.779 | S | S | * | * | 31.8 | 133.8 | 129.9 | -83.3 | -60.8 | 0 | 0 | 0 | 124.2 | |||||
| 166 | K | 36.1 | Very low | 37.7 | Very low | 157 Ų | 157 | 132.6 Ų | 132.6 | 68% | 0.683 | 78% | 0.782 | S | S | * | * | trans | 88.7 | 127.3 | 133.9 | -75.9 | 174.1 | -172.2 | -179.5 | 0 | 121.9 | ||||
| 167 | Q | 32.3 | Very low | 37.5 | Very low | 176 Ų | 176 | 133.2 Ų | 133.2 | 82% | 0.822 | 79% | 0.786 | S | S | * | * | trans | 69.1 | 162.1 | 135 | -71.2 | 171.9 | -13.6 | 0 | 0 | 117.9 | ||||
| 168 | S | 31.5 | Very low | 37.3 | Very low | 115 Ų | 115 | 133.5 Ų | 133.5 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | cis | -156.1 | 171 | -32.5 | -169.5 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 169 | A | 35.1 | Very low | 37.7 | Very low | 82 Ų | 82 | 131.5 Ų | 131.5 | 68% | 0.678 | 79% | 0.791 | S | S | * | * | trans | -57.3 | 146.3 | -173.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 170 | H | 36.1 | Very low | 38.1 | Very low | 201 Ų | 201 | 128.5 Ų | 128.5 | 93% | 0.931 | 79% | 0.788 | S | S | * | * | trans | -149.3 | 163.5 | 143.2 | -104.7 | 24.1 | 0 | 0 | 0 | 111.2 | ||||
| 171 | S | 37.3 | Very low | 38.8 | Very low | 106 Ų | 106 | 132.4 Ų | 132.4 | 74% | 0.741 | 80% | 0.797 | S | S | * | * | trans | -138.5 | 139.6 | -155.3 | 55.5 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 172 | I | 40.7 | Very low | 39.3 | Very low | 157 Ų | 157 | 131.8 Ų | 131.8 | 81% | 0.805 | 80% | 0.799 | S | S | * | * | trans | -138.7 | 126.2 | 159.3 | -58.3 | -178.2 | 0 | 0 | 0 | 109 | ||||
| 173 | P | 42.6 | Very low | 39.4 | Very low | 116 Ų | 116 | 130.1 Ų | 130.1 | 75% | 0.753 | 79% | 0.792 | S | S | * | * | trans | -92.9 | 142.4 | 172.7 | 35.2 | -31.5 | 0 | 0 | 0 | 112 | ||||
| 174 | T | 41.9 | Very low | 40.1 | Very low | 132 Ų | 132 | 130 Ų | 130 | 81% | 0.81 | 79% | 0.79 | S | S | * | * | trans | -120.7 | 96.5 | 174.4 | -57.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 175 | I | 47.8 | Very low | 41 | Very low | 154 Ų | 154 | 137.9 Ų | 137.9 | 79% | 0.79 | 80% | 0.798 | S | S | * | * | trans | 26.9 | 115.3 | 146.9 | -54.4 | 173.3 | 0 | 0 | 0 | 117.6 | ||||
| 176 | Q | 44.3 | Very low | 41.5 | Very low | 177 Ų | 177 | 132.1 Ų | 132.1 | 83% | 0.827 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -86 | 143.2 | 154.8 | -63.2 | -177.5 | 1.8 | 0 | 0 | 110.6 | ||
| 177 | P | 46.3 | Very low | 42.1 | Very low | 125 Ų | 125 | 130.4 Ų | 130.4 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -85.6 | 120.1 | 154.2 | 32.3 | -27.9 | 0 | 0 | 0 | 109.9 | ||
| 178 | S | 36.8 | Very low | 42.7 | Very low | 109 Ų | 109 | 131.3 Ų | 131.3 | 76% | 0.762 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -81 | 135.9 | 175.5 | 46.6 | 0 | 0 | 0 | 0 | 111.9 | ||
| 179 | S | 44.6 | Very low | 43.6 | Very low | 120 Ų | 120 | 130.5 Ų | 130.5 | 84% | 0.839 | 79% | 0.79 | S | S | * | * | trans | -119.3 | 79.9 | 168.3 | 50.9 | 0 | 0 | 0 | 0 | 110.4 | N181 | S179-N181 PolarHBondContact O-N 3.09Å; S179-N181 VanDerWaalsContact O-N 3.1Å | ||
| 180 | S | 45.7 | Very low | 44.4 | Very low | 106 Ų | 106 | 134.3 Ų | 134.3 | 74% | 0.741 | 79% | 0.793 | S | S | * | * | trans | -73.6 | 95.5 | -177.6 | 53.8 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 181 | N | 50 | Low | 44.9 | Very low | 168 Ų | 168 | 131.3 Ų | 131.3 | 90% | 0.898 | 78% | 0.784 | S | S | * | * | trans | -101 | 74.2 | 169.3 | -115.3 | 42.1 | 0 | 0 | 0 | 111.2 | S179 G183 | S179-N181 PolarHBondContact O-N 3.09Å; S179-N181 VanDerWaalsContact O-N 3.1Å; N181-G183 PolarHBondContact O-N 3.09Å | ||
| 182 | A | 43.4 | Very low | 45.7 | Very low | 100 Ų | 100 | 129.3 Ų | 129.3 | 83% | 0.826 | 77% | 0.774 | S | S | * | * | trans | -74.2 | 64.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | A184 | A182-A184 PolarHBondContact O-N 3.35Š| ||
| 183 | G | 36.8 | Very low | 46.4 | Very low | 67 Ų | 67 | 127.3 Ų | 127.3 | 69% | 0.691 | 77% | 0.771 | S | S | * | * | trans | -76.5 | 50.2 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | N181 R185 | N181-G183 PolarHBondContact O-N 3.09Å; G183-R185 PolarHBondContact O-N 2.83Å; G183-R185 VanDerWaalsContact O-N 3.15Å | ||
| 184 | A | 48.8 | Very low | 47.1 | Very low | 99 Ų | 99 | 132.7 Ų | 132.7 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | trans | -67.5 | 109.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | A182 | A182-A184 PolarHBondContact O-N 3.35Š| ||
| 185 | R | 49.7 | Very low | 47.6 | Very low | 236 Ų | 236 | 132 Ų | 132 | 89% | 0.891 | 78% | 0.776 | S | S | * | * | trans | -129.9 | 109.6 | 171.7 | -60.8 | -164.1 | 82.1 | -152.7 | 4.8 | 111.2 | G183 | G183-R185 PolarHBondContact O-N 2.83Å; G183-R185 VanDerWaalsContact O-N 3.15Å | ||
| 186 | A | 43.8 | Very low | 47.9 | Very low | 71 Ų | 71 | 129.4 Ų | 129.4 | 59% | 0.587 | 77% | 0.772 | S | S | * | * | trans | 46.4 | 105.9 | 162.1 | 0 | 0 | 0 | 0 | 0 | 118.2 | F188 | A186-F188 HydrophobicContact CB-CD2 3.85Å; A186-F188 HydrophobicContact CB-CE2 3.44Å; A186-F188 VanDerWaalsContact CB-CE2 3.44Å; A186-F188 HydrophobicContact CB-CZ 4.1Å; A186-F188 PolarHBondContact O-N 3.35Å; A186-F188 VanDerWaalsContact O-N 3.16Å | ||
| 187 | S | 48.7 | Very low | 48.6 | Very low | 121 Ų | 121 | 125.7 Ų | 125.7 | 85% | 0.846 | 77% | 0.765 | S | S | * | * | trans | -62.5 | 109.7 | 153.1 | -58.9 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 188 | F | 45 | Very low | 49.3 | Very low | 195 Ų | 195 | 126.5 Ų | 126.5 | 86% | 0.855 | 76% | 0.758 | S | S | * | * | trans | -104.9 | 93.8 | 158.8 | -70.5 | -72.9 | 0 | 0 | 0 | 108.1 | A186 | A186-F188 HydrophobicContact CB-CD2 3.85Å; A186-F188 HydrophobicContact CB-CE2 3.44Å; A186-F188 VanDerWaalsContact CB-CE2 3.44Å; A186-F188 HydrophobicContact CB-CZ 4.1Å; A186-F188 PolarHBondContact O-N 3.35Å; A186-F188 VanDerWaalsContact O-N 3.16Å | ||
| 189 | S | 49.8 | Very low | 50.7 | Low | 98 Ų | 98 | 127.4 Ų | 127.4 | 69% | 0.685 | 76% | 0.759 | S | S | * | * | trans | -65 | 140.3 | 169 | -63.5 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 190 | H | 52 | Low | 52.1 | Low | 162 Ų | 162 | 129.2 Ų | 129.2 | 75% | 0.75 | 75% | 0.752 | S | S | * | * | trans | 54.5 | 127.7 | 149.2 | -76 | -97 | 0 | 0 | 0 | 118.5 | ||||
| 191 | D | 47.1 | Very low | 53.6 | Low | 139 Ų | 139 | 130.1 Ų | 130.1 | 74% | 0.743 | 76% | 0.755 | S | S | * | * | cis | -142.9 | 127.9 | 16.7 | -78.3 | -63.1 | 0 | 0 | 0 | 112.4 | ||||
| 192 | A | 54.2 | Low | 55.2 | Low | 64 Ų | 64 | 133.5 Ų | 133.5 | 53% | 0.529 | 76% | 0.755 | S | S | . | * | trans | -147.7 | 84.5 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | W194 C195 | A192-W194 PolarHBondContact O-N 2.69Å; A192-C195 HydrophobicContact CB-CB 4.43Å; A192-C195 PolarHBondContact O-N 3.03Å | ||
| 193 | P | 54.9 | Low | 57.2 | Low | 115 Ų | 115 | 138.3 Ų | 138.3 | 75% | 0.747 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.9 | -15.7 | -166.4 | 22.8 | -33.4 | 0 | 0 | 0 | 114.9 | ||
| 194 | W | 56.7 | Low | 59.7 | Low | 229 Ų | 229 | 144.8 Ų | 144.8 | 87% | 0.867 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.8 | -15.4 | 179 | -58.2 | 92.7 | 0 | 0 | 0 | 113.9 | A192 | A192-W194 PolarHBondContact O-N 2.69Š|
| 195 | C | 52.8 | Low | 61.8 | Low | 116 Ų | 116 | 151 Ų | 151 | 78% | 0.784 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -104 | 16.3 | -173.8 | -69.5 | 0 | 0 | 0 | 0 | 114.4 | A192 | A192-C195 HydrophobicContact CB-CB 4.43Å; A192-C195 PolarHBondContact O-N 3.03Å |
| 196 | S | 55.1 | Low | 63.9 | Low | 101 Ų | 101 | 148.8 Ų | 148.8 | 71% | 0.706 | 77% | 0.766 | S | S | * | * | trans | -108.5 | 29.5 | 171 | -155.8 | 0 | 0 | 0 | 0 | 113.2 | Q198 | S196-Q198 VanDerWaalsContact C-N 3.31Å; S196-Q198 PolarHBondContact O-N 3.01Å | ||
| 197 | S | 57.9 | Low | 66.4 | Low | 99 Ų | 99 | 151 Ų | 151 | 69% | 0.692 | 77% | 0.774 | S | S | * | * | trans | -72.5 | 91.4 | 161.9 | -160.6 | 0 | 0 | 0 | 0 | 108.6 | V199 | S197-V199 WeakPolarHBondContact O-CG2 3.39Å; S197-V199 PolarHBondContact O-N 3.04Å | ||
| 198 | Q | 62.1 | Low | 68.7 | Low | 141 Ų | 141 | 148.4 Ų | 148.4 | 66% | 0.659 | 75% | 0.746 | S | S | * | * | trans | -54.6 | 105.1 | 166.4 | -72.6 | -175.8 | -13.2 | 0 | 0 | 108.2 | S196 K200 | S196-Q198 VanDerWaalsContact C-N 3.31Å; S196-Q198 PolarHBondContact O-N 3.01Å; Q198-K200 PolarHBondContact O-N 2.85Å | ||
| 199 | V | 65 | Low | 71.3 | Confident | 129 Ų | 129 | 142.6 Ų | 142.6 | 78% | 0.782 | 73% | 0.726 | S | S | * | * | trans | -74 | 72.5 | -179.2 | -171.6 | 0 | 0 | 0 | 0 | 108.9 | S197 P201 | S197-V199 WeakPolarHBondContact O-CG2 3.39Å; S197-V199 PolarHBondContact O-N 3.04Å; V199-P201 WeakPolarHBondContact O-CD 3.45Å | ||
| 200 | K | 74.3 | Confident | 73.6 | Confident | 158 Ų | 158 | 146.9 Ų | 146.9 | 69% | 0.687 | 73% | 0.733 | S | S | * | * | trans | -49.4 | 113.5 | 178.4 | -74.1 | 161.3 | -177.3 | 172.1 | 0 | 107.6 | Q198 R202 | Q198-K200 PolarHBondContact O-N 2.85Å; K200-R202 PolarHBondContact O-N 2.97Å | ||
| 201 | P | 77.9 | Confident | 75.8 | Confident | 124 Ų | 124 | 142.9 Ų | 142.9 | 81% | 0.805 | 72% | 0.721 | S | S | * | * | trans | -60.5 | 116.4 | -163.5 | 19.6 | -31.8 | 0 | 0 | 0 | 109.7 | V199 K203 | V199-P201 WeakPolarHBondContact O-CD 3.45Å; P201-K203 PolarHBondContact O-N 2.98Å | ||
| 202 | R | 83.2 | Confident | 78.2 | Confident | 240 Ų | 240 | 137.8 Ų | 137.8 | 91% | 0.906 | 69% | 0.693 | S | S | * | * | trans | -57.7 | 113.4 | -174.1 | -71.8 | -177.9 | 176.8 | 173.7 | -0.4 | 109.1 | K200 K204 | K200-R202 PolarHBondContact O-N 2.97Å; R202-K204 PolarHBondContact O-N 2.57Å; R202-K204 VanDerWaalsContact O-N 3.14Å | ||
| 203 | K | 86.2 | Confident | 80.3 | Confident | 201 Ų | 201 | 137.4 Ų | 137.4 | 87% | 0.874 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -49.4 | 120 | -177.5 | -168.5 | 166.8 | -175.4 | 171.5 | 0 | 109.5 | P201 R205 | P201-K203 PolarHBondContact O-N 2.98Å; K203-R205 PolarHBondContact O-N 3.01Å |
| 204 | K | 88.9 | Confident | 82.4 | Confident | 202 Ų | 202 | 134.7 Ų | 134.7 | 88% | 0.878 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 128.9 | -176.2 | -75.9 | -167.7 | 176.6 | -176.4 | 0 | 109.5 | R202 K206 | R202-K204 PolarHBondContact O-N 2.57Å; R202-K204 VanDerWaalsContact O-N 3.14Å; K204-K206 PolarHBondContact O-N 3.5Å |
| 205 | R | 92.7 | Very high | 84.4 | Confident | 229 Ų | 229 | 126.7 Ų | 126.7 | 86% | 0.864 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -70 | 121.6 | -177 | -61.3 | 177.6 | 71.9 | 167.8 | 2.3 | 108.8 | K203 | K203-R205 PolarHBondContact O-N 3.01Š|
| 206 | K | 93.8 | Very high | 86.6 | Confident | 191 Ų | 191 | 121.1 Ų | 121.1 | 83% | 0.83 | 60% | 0.604 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 137.5 | 162.1 | -65.4 | -171.8 | 176.3 | -172.4 | 0 | 108.4 | K204 | K204-K206 PolarHBondContact O-N 3.5Š|
| 207 | P | 96.1 | Very high | 88.6 | Confident | 117 Ų | 117 | 119.1 Ų | 119.1 | 76% | 0.76 | 58% | 0.583 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 156.7 | 165.9 | 31.3 | -34.1 | 0 | 0 | 0 | 110 | ||
| 208 | Y | 97.9 | Very high | 90.5 | Very high | 66 Ų | 66 | 118.7 Ų | 118.7 | 26% | 0.259 | 57% | 0.573 | S | S | . | * | P | Polyproline II helix | trans | -79.6 | 148.6 | 169.3 | -57.6 | -52.9 | 0 | 0 | 0 | 110.1 | L213 L240 Q244 W248 | Y208-L213 HydrophobicContact CD2-CD2 4.15Å; Y208-L213 HydrophobicContact CG-CD2 4.5Å; Y208-L240 HydrophobicContact CD1-CD1 4.18Å; Y208-L240 HydrophobicContact CD1-CD2 3.74Å; Y208-L240 HydrophobicContact CE1-CD1 4.09Å; Y208-L240 HydrophobicContact CE1-CD2 3.64Å; Y208-Q244 WeakPolarHBondContact OH-CB 3.26Å; Y208-W248 AromaticContact CD2-CD1 3.86Å; Y208-W248 AromaticContact CE2-CD1 3.72Å |
| 209 | T | 98.3 | Very high | 92.2 | Very high | 73 Ų | 73 | 113.2 Ų | 113.2 | 45% | 0.448 | 55% | 0.548 | S | S | . | . | P | Polyproline II helix | trans | -76.3 | 163.7 | 178.1 | 69.1 | 0 | 0 | 0 | 0 | 111.3 | Q212 L213 | T209-Q212 PolarHBondContact O-N 3.47Å; T209-Q212 VanDerWaalsContact OG1-CG 3.28Å; T209-Q212 WeakPolarHBondContact OG1-CG 3.45Å; T209-Q212 PolarHBondContact OG1-N 3Å; T209-Q212 PolarHBondContact OG1-OE1 3.35Å; T209-L213 WeakPolarHBondContact O-CG 3.17Å; T209-L213 PolarHBondContact O-N 3.35Å |
| 210 | K | 98.3 | Very high | 93.8 | Very high | 188 Ų | 188 | 107.4 Ų | 107.4 | 82% | 0.817 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -54.6 | -48.9 | 176.1 | -68.3 | -173.5 | 179.2 | -177.9 | 0 | 113.6 | L213 A214 | K210-L213 PolarHBondContact O-N 3.36Å; K210-A214 PolarHBondContact O-N 2.82Å |
| 211 | P | 98 | Very high | 95 | Very high | 79 Ų | 79 | 106.8 Ų | 106.8 | 51% | 0.513 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.2 | -40.7 | 177.1 | 23.3 | -33 | 0 | 0 | 0 | 113.1 | L213 A214 E215 | P211-L213 VanDerWaalsContact C-N 3.26Å; P211-L213 PolarHBondContact O-N 3.04Å; P211-A214 PolarHBondContact O-N 3.24Å; P211-A214 VanDerWaalsContact O-N 3.14Å; P211-E215 PolarHBondContact O-N 3.43Å |
| 212 | Q | 98.4 | Very high | 95.9 | Very high | 31 Ų | 31 | 107.1 Ų | 107.1 | 15% | 0.145 | 51% | 0.505 | C | S | . | . | H | α-helix | trans | -55.7 | -41.8 | 174.6 | -75 | 174.9 | -22.5 | 0 | 0 | 112.1 | T209 L216 L238 | T209-Q212 PolarHBondContact O-N 3.47Å; T209-Q212 VanDerWaalsContact OG1-CG 3.28Å; T209-Q212 WeakPolarHBondContact OG1-CG 3.45Å; T209-Q212 PolarHBondContact OG1-N 3Å; T209-Q212 PolarHBondContact OG1-OE1 3.35Å; Q212-L216 WeakPolarHBondContact O-CB 3.42Å; Q212-L216 VanDerWaalsContact O-CD1 3.26Å; Q212-L216 WeakPolarHBondContact O-CD1 3.18Å; Q212-L216 WeakPolarHBondContact O-CG 3.46Å; Q212-L216 PolarHBondContact O-N 3.23Å; Q212-L238 HydrophobicContact CG-CB 4.27Å; Q212-L238 HydrophobicContact CG-CD2 4.42Å; Q212-L238 PolarHBondContact NE2-O 3.13Å |
| 213 | L | 98.4 | Very high | 96.5 | Very high | 57 Ų | 57 | 100 Ų | 100 | 30% | 0.298 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.3 | -48.3 | 175.6 | -69.1 | 174.9 | 0 | 0 | 0 | 111.6 | Y208 T209 K210 P211 E215 L216 E217 | Y208-L213 HydrophobicContact CD2-CD2 4.15Å; Y208-L213 HydrophobicContact CG-CD2 4.5Å; T209-L213 WeakPolarHBondContact O-CG 3.17Å; T209-L213 PolarHBondContact O-N 3.35Å; K210-L213 PolarHBondContact O-N 3.36Å; P211-L213 VanDerWaalsContact C-N 3.26Å; P211-L213 PolarHBondContact O-N 3.04Å; L213-E215 PolarHBondContact O-N 3.04Å; L213-L216 PolarHBondContact O-N 3.25Å; L213-E217 WeakPolarHBondContact O-CB 2.77Å; L213-E217 PolarHBondContact O-N 3.18Å |
| 214 | A | 98.4 | Very high | 97.1 | Very high | 57 Ų | 57 | 93.4 Ų | 93.4 | 47% | 0.471 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -57.6 | -43.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | K210 P211 E217 N218 | K210-A214 PolarHBondContact O-N 2.82Å; P211-A214 PolarHBondContact O-N 3.24Å; P211-A214 VanDerWaalsContact O-N 3.14Å; A214-E217 PolarHBondContact O-N 2.97Å; A214-N218 WeakPolarHBondContact O-CB 3.38Å; A214-N218 PolarHBondContact O-N 2.94Å |
| 215 | E | 98.2 | Very high | 97.5 | Very high | 61 Ų | 61 | 89.7 Ų | 89.7 | 29% | 0.285 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -69.9 | -38.1 | 177.5 | -71.1 | -175.7 | -120.2 | 0 | 0 | 112.7 | P211 L213 N218 E219 R237 L238 | P211-E215 PolarHBondContact O-N 3.43Å; L213-E215 PolarHBondContact O-N 3.04Å; E215-N218 PolarHBondContact O-N 3.4Å; E215-E219 WeakPolarHBondContact O-CB 3.37Å; E215-E219 WeakPolarHBondContact O-CG 3.26Å; E215-E219 PolarHBondContact O-N 2.81Å; E215-R237 VanDerWaalsContact OE2-CD 3.28Å; E215-R237 WeakPolarHBondContact OE2-CD 2.99Å; E215-R237 WeakPolarHBondContact OE2-CG 2.87Å; E215-R237 IonicContact OE2-CZ 3.59Å; E215-R237 IonicContact OE2-NE 3.35Å; E215-R237 IonicContact OE2-NH1 2.98Å; E215-R237 PolarHBondContact OE2-NH1 3.47Å; E215-L238 HydrophobicContact CB-CD1 4.29Å; E215-L238 HydrophobicContact CB-CD2 4.04Å; E215-L238 HydrophobicContact CG-CD2 4.31Å; E215-L238 WeakPolarHBondContact OE1-CD2 3.42Å |
| 216 | L | 98.6 | Very high | 97.7 | Very high | 0 Ų | 0 | 79.9 Ų | 79.9 | 0% | 0 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -66.4 | -37.3 | 173.2 | -70.2 | 167.9 | 0 | 0 | 0 | 111.9 | Q212 L213 Y220 L234 L238 L240 V245 W248 F249 | Q212-L216 WeakPolarHBondContact O-CB 3.42Å; Q212-L216 VanDerWaalsContact O-CD1 3.26Å; Q212-L216 WeakPolarHBondContact O-CD1 3.18Å; Q212-L216 WeakPolarHBondContact O-CG 3.46Å; Q212-L216 PolarHBondContact O-N 3.23Å; L213-L216 PolarHBondContact O-N 3.25Å; L216-Y220 WeakPolarHBondContact O-CB 3.32Å; L216-Y220 PolarHBondContact O-N 2.82Å; L216-L234 HydrophobicContact CD2-CD1 4.15Å; L216-L234 HydrophobicContact CD2-CD2 4.13Å; L216-L238 HydrophobicContact CD1-CD1 4.23Å; L216-L238 HydrophobicContact CD2-CD1 4.01Å; L216-L238 HydrophobicContact CG-CD1 3.71Å; L216-L240 HydrophobicContact CD1-CD1 3.97Å; L216-V245 HydrophobicContact CD2-CG1 4.01Å; L216-W248 HydrophobicContact CB-CD2 3.88Å; L216-W248 HydrophobicContact CB-CE3 3.91Å; L216-W248 HydrophobicContact CB-CH2 3.68Å; L216-W248 HydrophobicContact CB-CZ2 3.6Å; L216-W248 HydrophobicContact CB-CZ3 3.82Å; L216-W248 HydrophobicContact CD1-CB 4.45Å; L216-W248 HydrophobicContact CD1-CD2 3.92Å; L216-W248 HydrophobicContact CD1-CG 3.81Å; L216-W248 HydrophobicContact CD2-CE3 4.39Å; L216-W248 HydrophobicContact CG-CD2 4.33Å; L216-W248 VanDerWaalsContact O-CH2 3.27Å; L216-W248 WeakPolarHBondContact O-CH2 3.48Å; L216-W248 WeakPolarHBondContact O-CZ3 3.48Å; L216-F249 HydrophobicContact CD2-CE2 3.99Å |
| 217 | E | 98.5 | Very high | 98 | Very high | 59 Ų | 59 | 75.2 Ų | 75.2 | 28% | 0.276 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -68.1 | -41.7 | 174.7 | -105 | 109.6 | -146.5 | 0 | 0 | 112.3 | L213 A214 Y220 M221 W248 R252 | L213-E217 WeakPolarHBondContact O-CB 2.77Å; L213-E217 PolarHBondContact O-N 3.18Å; A214-E217 PolarHBondContact O-N 2.97Å; E217-Y220 WeakPolarHBondContact O-CB 3.07Å; E217-Y220 PolarHBondContact O-N 3.41Å; E217-M221 WeakPolarHBondContact O-CG 3.21Å; E217-M221 PolarHBondContact O-N 3.32Å; E217-W248 HydrophobicContact CG-CH2 4.25Å; E217-W248 HydrophobicContact CG-CZ2 4.26Å; E217-W248 WeakPolarHBondContact OE1-CZ2 3.38Å; E217-R252 IonicContact OE1-NE 2.69Å |
| 218 | N | 98.1 | Very high | 98 | Very high | 89 Ų | 89 | 79.6 Ų | 79.6 | 48% | 0.476 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -61 | -50.1 | 175.4 | 179.8 | 66.6 | 0 | 0 | 0 | 111.8 | A214 E215 Y220 M221 M222 | A214-N218 WeakPolarHBondContact O-CB 3.38Å; A214-N218 PolarHBondContact O-N 2.94Å; E215-N218 PolarHBondContact O-N 3.4Å; N218-Y220 VanDerWaalsContact C-N 3.26Å; N218-Y220 PolarHBondContact O-N 2.83Å; N218-M221 WeakPolarHBondContact O-CB 3.38Å; N218-M221 PolarHBondContact O-N 3.31Å; N218-M221 VanDerWaalsContact O-N 3.08Å; N218-M222 PolarHBondContact O-N 3.03Å |
| 219 | E | 98.1 | Very high | 98 | Very high | 27 Ų | 27 | 81.9 Ų | 81.9 | 13% | 0.126 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -67 | -30.1 | 179.7 | -63.4 | -92.1 | -150.6 | 0 | 0 | 111.5 | E215 M222 N223 K230 L234 R237 F249 | E215-E219 WeakPolarHBondContact O-CB 3.37Å; E215-E219 WeakPolarHBondContact O-CG 3.26Å; E215-E219 PolarHBondContact O-N 2.81Å; E219-M222 PolarHBondContact O-N 3.3Å; E219-N223 PolarHBondContact O-N 3.47Å; E219-K230 WeakPolarHBondContact OE1-CE 3.47Å; E219-K230 IonicContact OE1-NZ 3.74Å; E219-K230 PolarHBondContact OE1-NZ 2.78Å; E219-K230 WeakPolarHBondContact OE2-CE 3.36Å; E219-K230 IonicContact OE2-NZ 3.09Å; E219-L234 HydrophobicContact CB-CD1 3.85Å; E219-L234 HydrophobicContact CG-CD1 3.86Å; E219-L234 HydrophobicContact CG-CD2 4.22Å; E219-L234 HydrophobicContact CG-CG 4.32Å; E219-R237 IonicContact OE1-CZ 3.62Å; E219-R237 IonicContact OE1-NH1 3.8Å; E219-R237 IonicContact OE1-NH2 2.7Å; E219-R237 PolarHBondContact OE1-NH2 3Å; E219-F249 HydrophobicContact CB-CZ 4.38Å |
| 220 | Y | 98.4 | Very high | 98 | Very high | 6 Ų | 6 | 81.3 Ų | 81.3 | 2% | 0.024 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -67.5 | -34.1 | 171 | -176 | -85.7 | 0 | 0 | 0 | 113.5 | L216 E217 N218 M222 N223 E224 W248 F249 R252 R253 | L216-Y220 WeakPolarHBondContact O-CB 3.32Å; L216-Y220 PolarHBondContact O-N 2.82Å; E217-Y220 WeakPolarHBondContact O-CB 3.07Å; E217-Y220 PolarHBondContact O-N 3.41Å; N218-Y220 VanDerWaalsContact C-N 3.26Å; N218-Y220 PolarHBondContact O-N 2.83Å; Y220-M222 VanDerWaalsContact C-N 3.31Å; Y220-N223 CarbonylContact O-C 3.38Å; Y220-N223 VanDerWaalsContact O-C 3.29Å; Y220-N223 PolarHBondContact O-N 3.42Å; Y220-E224 HydrophobicContact CE1-CB 4.46Å; Y220-E224 HydrophobicContact CE1-CG 3.99Å; Y220-E224 WeakPolarHBondContact CE1-OE1 3.29Å; Y220-E224 HydrophobicContact CE2-CB 3.89Å; Y220-E224 HydrophobicContact CE2-CG 4.33Å; Y220-E224 PolarHBondContact O-N 3.45Å; Y220-E224 PolarHBondContact OH-OE1 2.9Å; Y220-W248 HydrophobicContact CD2-CZ3 4.16Å; Y220-W248 HydrophobicContact CG-CZ3 4.34Å; Y220-F249 AromaticContact CD2-CD1 3.86Å; Y220-F249 HydrophobicContact CD2-CD1 3.86Å; Y220-F249 AromaticContact CD2-CE1 3.85Å; Y220-F249 HydrophobicContact CD2-CE1 3.85Å; Y220-F249 HydrophobicContact CG-CE1 4.46Å; Y220-R252 HydrophobicContact CD1-CG 3.92Å; Y220-R252 HydrophobicContact CD2-CB 3.99Å; Y220-R252 HydrophobicContact CD2-CG 3.38Å; Y220-R252 HydrophobicContact CE1-CG 4.01Å; Y220-R252 HydrophobicContact CE2-CB 3.91Å; Y220-R252 HydrophobicContact CE2-CG 3.44Å; Y220-R252 VanDerWaalsContact CE2-CG 3.44Å; Y220-R252 HydrophobicContact CG-CG 3.64Å; Y220-R253 HydrophobicContact CE2-CG 3.75Å; Y220-R253 WeakPolarHBondContact OH-CG 3.27Å |
| 221 | M | 97.8 | Very high | 98 | Very high | 145 Ų | 145 | 74.7 Ų | 74.7 | 71% | 0.714 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -67.9 | -32.6 | 173.7 | -73.1 | 171.8 | 56.9 | 0 | 0 | 111.8 | E217 N218 | E217-M221 WeakPolarHBondContact O-CG 3.21Å; E217-M221 PolarHBondContact O-N 3.32Å; N218-M221 WeakPolarHBondContact O-CB 3.38Å; N218-M221 PolarHBondContact O-N 3.31Å; N218-M221 VanDerWaalsContact O-N 3.08Å |
| 222 | M | 97.4 | Very high | 98 | Very high | 131 Ų | 131 | 75.8 Ų | 75.8 | 65% | 0.645 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -73 | -39.7 | 173.8 | -57.8 | -58.6 | 104.1 | 0 | 0 | 111.9 | N218 E219 Y220 | N218-M222 PolarHBondContact O-N 3.03Å; E219-M222 PolarHBondContact O-N 3.3Å; Y220-M222 VanDerWaalsContact C-N 3.31Å |
| 223 | N | 96.6 | Very high | 98 | Very high | 91 Ų | 91 | 77.4 Ų | 77.4 | 49% | 0.487 | 37% | 0.37 | S | S | . | . | trans | -155.8 | 123.7 | 175.5 | -171.4 | -18.3 | 0 | 0 | 0 | 112.3 | E219 Y220 F225 | E219-N223 PolarHBondContact O-N 3.47Å; Y220-N223 CarbonylContact O-C 3.38Å; Y220-N223 VanDerWaalsContact O-C 3.29Å; Y220-N223 PolarHBondContact O-N 3.42Å; N223-F225 PolarHBondContact ND2-O 2.97Å; N223-F225 PolarHBondContact O-N 2.9Å; N223-F225 VanDerWaalsContact O-N 3.09Å; N223-F225 PolarHBondContact OD1-N 2.77Å; N223-F225 PolarHBondContact OD1-O 3.48Å | ||
| 224 | E | 97.5 | Very high | 98 | Very high | 63 Ų | 63 | 74.7 Ų | 74.7 | 29% | 0.294 | 36% | 0.356 | S | S | . | . | S | Bend | trans | -66.8 | -12 | 179.1 | -51.3 | -152.3 | 112 | 0 | 0 | 113.9 | Y220 R253 K256 | Y220-E224 HydrophobicContact CE1-CB 4.46Å; Y220-E224 HydrophobicContact CE1-CG 3.99Å; Y220-E224 WeakPolarHBondContact CE1-OE1 3.29Å; Y220-E224 HydrophobicContact CE2-CB 3.89Å; Y220-E224 HydrophobicContact CE2-CG 4.33Å; Y220-E224 PolarHBondContact O-N 3.45Å; Y220-E224 PolarHBondContact OH-OE1 2.9Å; E224-R253 HydrophobicContact CB-CG 4.42Å; E224-R253 VanDerWaalsContact O-CD 3.3Å; E224-R253 WeakPolarHBondContact O-CD 3.44Å; E224-R253 PolarHBondContact O-NE 3.4Å; E224-K256 WeakPolarHBondContact OE1-CD 3.38Å; E224-K256 WeakPolarHBondContact OE1-CE 3.26Å; E224-K256 IonicContact OE1-NZ 3.68Å; E224-K256 PolarHBondContact OE1-NZ 2.98Å; E224-K256 IonicContact OE2-NZ 2.81Å; E224-K256 PolarHBondContact OE2-NZ 2.87Å |
| 225 | F | 98.1 | Very high | 98 | Very high | 124 Ų | 124 | 72.8 Ų | 72.8 | 54% | 0.544 | 34% | 0.339 | S | S | . | . | S | Bend | trans | -125.4 | 103.9 | -177.6 | -68.9 | -106.2 | 0 | 0 | 0 | 111.9 | N223 N227 | N223-F225 PolarHBondContact ND2-O 2.97Å; N223-F225 PolarHBondContact O-N 2.9Å; N223-F225 VanDerWaalsContact O-N 3.09Å; N223-F225 PolarHBondContact OD1-N 2.77Å; N223-F225 PolarHBondContact OD1-O 3.48Å; F225-N227 PolarHBondContact O-N 2.59Å |
| 226 | I | 97.9 | Very high | 98 | Very high | 23 Ų | 23 | 75.8 Ų | 75.8 | 12% | 0.118 | 35% | 0.353 | C | S | . | . | trans | -76 | 121.6 | -179.5 | -163.4 | 171.3 | 0 | 0 | 0 | 113.7 | K230 R231 L234 V245 F249 | I226-K230 HydrophobicContact CG1-CB 4.11Å; I226-K230 HydrophobicContact CG1-CG 4.36Å; I226-R231 VanDerWaalsContact CD1-CA 3.46Å; I226-R231 HydrophobicContact CD1-CB 3.86Å; I226-R231 HydrophobicContact CD1-CG 4.36Å; I226-R231 HydrophobicContact CG1-CB 4.04Å; I226-R231 HydrophobicContact CG2-CB 4.49Å; I226-R231 PolarHBondContact O-NH2 2.69Å; I226-L234 HydrophobicContact CD1-CB 4.5Å; I226-L234 HydrophobicContact CD1-CD1 3.46Å; I226-L234 VanDerWaalsContact CD1-CD1 3.46Å; I226-V245 HydrophobicContact CD1-CG1 3.77Å; I226-F249 HydrophobicContact CB-CD1 3.86Å; I226-F249 HydrophobicContact CB-CD2 4.1Å; I226-F249 HydrophobicContact CB-CE1 3.84Å; I226-F249 HydrophobicContact CB-CE2 4.09Å; I226-F249 HydrophobicContact CB-CG 4Å; I226-F249 HydrophobicContact CB-CZ 3.97Å; I226-F249 HydrophobicContact CD1-CD2 4.21Å; I226-F249 HydrophobicContact CD1-CE2 3.71Å; I226-F249 HydrophobicContact CD1-CZ 3.99Å; I226-F249 HydrophobicContact CG1-CE2 4.46Å; I226-F249 HydrophobicContact CG1-CZ 4.41Å; I226-F249 HydrophobicContact CG2-CB 4.02Å; I226-F249 HydrophobicContact CG2-CD1 3.97Å; I226-F249 HydrophobicContact CG2-CD2 3.75Å; I226-F249 HydrophobicContact CG2-CE1 4.41Å; I226-F249 HydrophobicContact CG2-CE2 4.22Å; I226-F249 HydrophobicContact CG2-CG 3.62Å | ||
| 227 | N | 98.1 | Very high | 98 | Very high | 92 Ų | 92 | 80.8 Ų | 80.8 | 49% | 0.492 | 37% | 0.372 | S | S | . | . | trans | -67.8 | -179.7 | 174.7 | 77.1 | 38.4 | 0 | 0 | 0 | 112.1 | F225 Q229 K230 R231 | F225-N227 PolarHBondContact O-N 2.59Å; N227-Q229 PolarHBondContact OD1-N 3.09Å; N227-K230 VanDerWaalsContact OD1-CB 3.31Å; N227-K230 WeakPolarHBondContact OD1-CB 3.44Å; N227-K230 PolarHBondContact OD1-N 2.9Å; N227-R231 VanDerWaalsContact O-CB 3.27Å; N227-R231 WeakPolarHBondContact O-CB 3.31Å; N227-R231 PolarHBondContact O-N 2.91Å; N227-R231 PolarHBondContact O-NH2 3.4Å | ||
| 228 | R | 97.9 | Very high | 97.9 | Very high | 210 Ų | 210 | 78.3 Ų | 78.3 | 79% | 0.792 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -69.9 | -50.2 | -178.7 | -177 | -176.8 | 176.2 | -146.8 | -0.8 | 112.6 | R231 K232 | R228-R231 WeakPolarHBondContact O-CB 3.43Å; R228-R231 PolarHBondContact O-N 3.42Å; R228-K232 PolarHBondContact O-N 3.42Å |
| 229 | Q | 97.9 | Very high | 97.9 | Very high | 114 Ų | 114 | 81.4 Ų | 81.4 | 53% | 0.533 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -62.1 | -51 | -174.7 | 172.9 | 54.4 | 27.9 | 0 | 0 | 111.2 | N227 R231 K232 E233 | N227-Q229 PolarHBondContact OD1-N 3.09Å; Q229-R231 PolarHBondContact O-N 3.29Å; Q229-K232 WeakPolarHBondContact O-CB 3.48Å; Q229-K232 PolarHBondContact O-N 3.32Å; Q229-E233 WeakPolarHBondContact CG-OE1 3.39Å; Q229-E233 PolarHBondContact NE2-OE1 3.4Å; Q229-E233 PolarHBondContact O-N 2.98Å; Q229-E233 VanDerWaalsContact O-N 3.09Å |
| 230 | K | 97.8 | Very high | 97.9 | Very high | 60 Ų | 60 | 80.7 Ų | 80.7 | 26% | 0.261 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -64.3 | -28.2 | -178.9 | -162.9 | 55.3 | 171.1 | 168.5 | 0 | 113.3 | E219 I226 N227 E233 L234 | E219-K230 WeakPolarHBondContact OE1-CE 3.47Å; E219-K230 IonicContact OE1-NZ 3.74Å; E219-K230 PolarHBondContact OE1-NZ 2.78Å; E219-K230 WeakPolarHBondContact OE2-CE 3.36Å; E219-K230 IonicContact OE2-NZ 3.09Å; I226-K230 HydrophobicContact CG1-CB 4.11Å; I226-K230 HydrophobicContact CG1-CG 4.36Å; N227-K230 VanDerWaalsContact OD1-CB 3.31Å; N227-K230 WeakPolarHBondContact OD1-CB 3.44Å; N227-K230 PolarHBondContact OD1-N 2.9Å; K230-E233 WeakPolarHBondContact CD-OE2 3.22Å; K230-E233 IonicContact NZ-OE2 3.7Å; K230-E233 PolarHBondContact NZ-OE2 3.46Å; K230-E233 VanDerWaalsContact NZ-OE2 3.09Å; K230-L234 WeakPolarHBondContact O-CB 3.31Å; K230-L234 PolarHBondContact O-N 3.1Å |
| 231 | R | 98.5 | Very high | 97.9 | Very high | 50 Ų | 50 | 82.8 Ų | 82.8 | 19% | 0.189 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -69 | -40.2 | 173.1 | -171.3 | -172.4 | -51.7 | 137.5 | 12.8 | 112.2 | I226 N227 R228 Q229 L234 S235 D242 V245 | I226-R231 VanDerWaalsContact CD1-CA 3.46Å; I226-R231 HydrophobicContact CD1-CB 3.86Å; I226-R231 HydrophobicContact CD1-CG 4.36Å; I226-R231 HydrophobicContact CG1-CB 4.04Å; I226-R231 HydrophobicContact CG2-CB 4.49Å; I226-R231 PolarHBondContact O-NH2 2.69Å; N227-R231 VanDerWaalsContact O-CB 3.27Å; N227-R231 WeakPolarHBondContact O-CB 3.31Å; N227-R231 PolarHBondContact O-N 2.91Å; N227-R231 PolarHBondContact O-NH2 3.4Å; R228-R231 WeakPolarHBondContact O-CB 3.43Å; R228-R231 PolarHBondContact O-N 3.42Å; Q229-R231 PolarHBondContact O-N 3.29Å; R231-L234 PolarHBondContact O-N 3.27Å; R231-S235 VanDerWaalsContact O-CB 3.31Å; R231-S235 WeakPolarHBondContact O-CB 3.34Å; R231-S235 PolarHBondContact O-N 3.02Å; R231-D242 WeakPolarHBondContact CD-O 3.45Å; R231-D242 VanDerWaalsContact CD-OD2 3.32Å; R231-D242 WeakPolarHBondContact CD-OD2 3.47Å; R231-V245 HydrophobicContact CG-CB 3.97Å; R231-V245 HydrophobicContact CG-CG1 3.86Å |
| 232 | K | 98.5 | Very high | 97.9 | Very high | 101 Ų | 101 | 78.9 Ų | 78.9 | 44% | 0.439 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -63.2 | -48.3 | 174 | -172.8 | -170.3 | 163.2 | -169.5 | 0 | 110.5 | R228 Q229 L234 S235 E236 | R228-K232 PolarHBondContact O-N 3.42Å; Q229-K232 WeakPolarHBondContact O-CB 3.48Å; Q229-K232 PolarHBondContact O-N 3.32Å; K232-L234 VanDerWaalsContact C-N 3.3Å; K232-L234 PolarHBondContact O-N 3.14Å; K232-S235 WeakPolarHBondContact O-CA 3.39Å; K232-S235 VanDerWaalsContact O-CB 3.22Å; K232-S235 WeakPolarHBondContact O-CB 3.44Å; K232-S235 PolarHBondContact O-N 3Å; K232-E236 WeakPolarHBondContact CE-OE1 3.48Å; K232-E236 VanDerWaalsContact CE-OE2 3.32Å; K232-E236 WeakPolarHBondContact CE-OE2 3.38Å; K232-E236 HydrophobicContact CG-CG 4.49Å; K232-E236 IonicContact NZ-OE1 2.77Å; K232-E236 PolarHBondContact NZ-OE1 3.05Å; K232-E236 PolarHBondContact O-N 3.2Å |
| 233 | E | 98.3 | Very high | 97.9 | Very high | 66 Ų | 66 | 79 Ų | 79 | 31% | 0.308 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -56.2 | -41 | 175.9 | -69.6 | 166.2 | -150.3 | 0 | 0 | 113.1 | Q229 K230 R237 | Q229-E233 WeakPolarHBondContact CG-OE1 3.39Å; Q229-E233 PolarHBondContact NE2-OE1 3.4Å; Q229-E233 PolarHBondContact O-N 2.98Å; Q229-E233 VanDerWaalsContact O-N 3.09Å; K230-E233 WeakPolarHBondContact CD-OE2 3.22Å; K230-E233 IonicContact NZ-OE2 3.7Å; K230-E233 PolarHBondContact NZ-OE2 3.46Å; K230-E233 VanDerWaalsContact NZ-OE2 3.09Å; E233-R237 WeakPolarHBondContact O-CB 3.38Å; E233-R237 PolarHBondContact O-N 3.14Å; E233-R237 VanDerWaalsContact O-N 3.11Å |
| 234 | L | 98 | Very high | 98 | Very high | 0 Ų | 0 | 78.2 Ų | 78.2 | 0% | 0 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -74.1 | -28.5 | 174.4 | -92.9 | 168 | 0 | 0 | 0 | 113.3 | L216 E219 I226 K230 R231 K232 L238 V245 F249 | L216-L234 HydrophobicContact CD2-CD1 4.15Å; L216-L234 HydrophobicContact CD2-CD2 4.13Å; E219-L234 HydrophobicContact CB-CD1 3.85Å; E219-L234 HydrophobicContact CG-CD1 3.86Å; E219-L234 HydrophobicContact CG-CD2 4.22Å; E219-L234 HydrophobicContact CG-CG 4.32Å; I226-L234 HydrophobicContact CD1-CB 4.5Å; I226-L234 HydrophobicContact CD1-CD1 3.46Å; I226-L234 VanDerWaalsContact CD1-CD1 3.46Å; K230-L234 WeakPolarHBondContact O-CB 3.31Å; K230-L234 PolarHBondContact O-N 3.1Å; R231-L234 PolarHBondContact O-N 3.27Å; K232-L234 VanDerWaalsContact C-N 3.3Å; K232-L234 PolarHBondContact O-N 3.14Å; L234-L238 HydrophobicContact CD2-CD1 3.53Å; L234-L238 HydrophobicContact CD2-CG 4.08Å; L234-L238 VanDerWaalsContact O-CB 3.26Å; L234-L238 WeakPolarHBondContact O-CB 3.42Å; L234-L238 WeakPolarHBondContact O-CG 3.36Å; L234-L238 PolarHBondContact O-N 3.39Å; L234-V245 HydrophobicContact CB-CG1 4.21Å; L234-V245 HydrophobicContact CB-CG2 4.48Å; L234-V245 HydrophobicContact CD1-CG1 4.48Å; L234-F249 HydrophobicContact CD1-CE2 4.24Å |
| 235 | S | 98.4 | Very high | 98 | Very high | 17 Ų | 17 | 75.2 Ų | 75.2 | 12% | 0.119 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -64.7 | -52 | 174.5 | -164.9 | 0 | 0 | 0 | 0 | 109.7 | R231 K232 D239 L240 S241 D242 | R231-S235 VanDerWaalsContact O-CB 3.31Å; R231-S235 WeakPolarHBondContact O-CB 3.34Å; R231-S235 PolarHBondContact O-N 3.02Å; K232-S235 WeakPolarHBondContact O-CA 3.39Å; K232-S235 VanDerWaalsContact O-CB 3.22Å; K232-S235 WeakPolarHBondContact O-CB 3.44Å; K232-S235 PolarHBondContact O-N 3Å; S235-D239 PolarHBondContact O-N 2.81Å; S235-L240 CarbonylContact C-O 3.29Å; S235-L240 VanDerWaalsContact CA-O 3.29Å; S235-L240 WeakPolarHBondContact CA-O 3.45Å; S235-L240 WeakPolarHBondContact CB-O 3.47Å; S235-L240 PolarHBondContact O-N 2.92Å; S235-L240 PolarHBondContact OG-O 3.14Å; S235-S241 VanDerWaalsContact OG-C 3.25Å; S235-S241 WeakPolarHBondContact OG-CA 3.25Å; S235-D242 PolarHBondContact OG-N 3.23Å |
| 236 | E | 98.2 | Very high | 98 | Very high | 124 Ų | 124 | 74.2 Ų | 74.2 | 58% | 0.579 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -69 | -40.8 | -176.9 | -68 | 172.7 | 148.9 | 0 | 0 | 112.4 | K232 L238 | K232-E236 WeakPolarHBondContact CE-OE1 3.48Å; K232-E236 VanDerWaalsContact CE-OE2 3.32Å; K232-E236 WeakPolarHBondContact CE-OE2 3.38Å; K232-E236 HydrophobicContact CG-CG 4.49Å; K232-E236 IonicContact NZ-OE1 2.77Å; K232-E236 PolarHBondContact NZ-OE1 3.05Å; K232-E236 PolarHBondContact O-N 3.2Å; E236-L238 PolarHBondContact O-N 2.97Å |
| 237 | R | 97.7 | Very high | 98.1 | Very high | 105 Ų | 105 | 76.1 Ų | 76.1 | 40% | 0.396 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -72 | -23.5 | -179.6 | 173.1 | 163.2 | 38.3 | 109.2 | -9.5 | 114.8 | E215 E219 E233 | E215-R237 VanDerWaalsContact OE2-CD 3.28Å; E215-R237 WeakPolarHBondContact OE2-CD 2.99Å; E215-R237 WeakPolarHBondContact OE2-CG 2.87Å; E215-R237 IonicContact OE2-CZ 3.59Å; E215-R237 IonicContact OE2-NE 3.35Å; E215-R237 IonicContact OE2-NH1 2.98Å; E215-R237 PolarHBondContact OE2-NH1 3.47Å; E219-R237 IonicContact OE1-CZ 3.62Å; E219-R237 IonicContact OE1-NH1 3.8Å; E219-R237 IonicContact OE1-NH2 2.7Å; E219-R237 PolarHBondContact OE1-NH2 3Å; E233-R237 WeakPolarHBondContact O-CB 3.38Å; E233-R237 PolarHBondContact O-N 3.14Å; E233-R237 VanDerWaalsContact O-N 3.11Å |
| 238 | L | 97.8 | Very high | 98.1 | Very high | 7 Ų | 7 | 72.6 Ų | 72.6 | 4% | 0.037 | 34% | 0.335 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -112.8 | 4.2 | -171.6 | -63.2 | -173.6 | 0 | 0 | 0 | 115 | Q212 E215 L216 L234 E236 L240 | Q212-L238 HydrophobicContact CG-CB 4.27Å; Q212-L238 HydrophobicContact CG-CD2 4.42Å; Q212-L238 PolarHBondContact NE2-O 3.13Å; E215-L238 HydrophobicContact CB-CD1 4.29Å; E215-L238 HydrophobicContact CB-CD2 4.04Å; E215-L238 HydrophobicContact CG-CD2 4.31Å; E215-L238 WeakPolarHBondContact OE1-CD2 3.42Å; L216-L238 HydrophobicContact CD1-CD1 4.23Å; L216-L238 HydrophobicContact CD2-CD1 4.01Å; L216-L238 HydrophobicContact CG-CD1 3.71Å; L234-L238 HydrophobicContact CD2-CD1 3.53Å; L234-L238 HydrophobicContact CD2-CG 4.08Å; L234-L238 VanDerWaalsContact O-CB 3.26Å; L234-L238 WeakPolarHBondContact O-CB 3.42Å; L234-L238 WeakPolarHBondContact O-CG 3.36Å; L234-L238 PolarHBondContact O-N 3.39Å; E236-L238 PolarHBondContact O-N 2.97Å; L238-L240 HydrophobicContact CB-CB 4.46Å; L238-L240 HydrophobicContact CB-CD1 4.15Å; L238-L240 HydrophobicContact CB-CG 3.93Å; L238-L240 HydrophobicContact CD1-CD1 4.33Å; L238-L240 PolarHBondContact O-N 3.1Å |
| 239 | D | 98 | Very high | 98.1 | Very high | 154 Ų | 154 | 62.9 Ų | 62.9 | 82% | 0.824 | 30% | 0.298 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.6 | 36.5 | -170.1 | -65.2 | -51.9 | 0 | 0 | 0 | 113.2 | S235 | S235-D239 PolarHBondContact O-N 2.81Š|
| 240 | L | 97.5 | Very high | 98.2 | Very high | 12 Ų | 12 | 61.6 Ų | 61.6 | 6% | 0.063 | 29% | 0.292 | C | S | . | . | trans | -112.1 | 155 | 176.3 | -61.5 | -174.3 | 0 | 0 | 0 | 109.6 | Y208 L216 S235 L238 Q244 V245 | Y208-L240 HydrophobicContact CD1-CD1 4.18Å; Y208-L240 HydrophobicContact CD1-CD2 3.74Å; Y208-L240 HydrophobicContact CE1-CD1 4.09Å; Y208-L240 HydrophobicContact CE1-CD2 3.64Å; L216-L240 HydrophobicContact CD1-CD1 3.97Å; S235-L240 CarbonylContact C-O 3.29Å; S235-L240 VanDerWaalsContact CA-O 3.29Å; S235-L240 WeakPolarHBondContact CA-O 3.45Å; S235-L240 WeakPolarHBondContact CB-O 3.47Å; S235-L240 PolarHBondContact O-N 2.92Å; S235-L240 PolarHBondContact OG-O 3.14Å; L238-L240 HydrophobicContact CB-CB 4.46Å; L238-L240 HydrophobicContact CB-CD1 4.15Å; L238-L240 HydrophobicContact CB-CG 3.93Å; L238-L240 HydrophobicContact CD1-CD1 4.33Å; L238-L240 PolarHBondContact O-N 3.1Å; L240-Q244 HydrophobicContact CB-CB 4.36Å; L240-V245 HydrophobicContact CB-CG2 4.08Å; L240-V245 HydrophobicContact CD1-CG2 4.46Å | ||
| 241 | S | 98.1 | Very high | 98.2 | Very high | 50 Ų | 50 | 63 Ų | 63 | 35% | 0.35 | 30% | 0.303 | S | S | . | . | trans | -81.2 | 151.5 | 168.4 | 60.8 | 0 | 0 | 0 | 0 | 112.5 | S235 Q243 Q244 V245 | S235-S241 VanDerWaalsContact OG-C 3.25Å; S235-S241 WeakPolarHBondContact OG-CA 3.25Å; S241-Q243 PolarHBondContact O-N 2.98Å; S241-Q244 WeakPolarHBondContact O-CA 3.4Å; S241-Q244 WeakPolarHBondContact O-CB 3.02Å; S241-Q244 PolarHBondContact O-N 3.29Å; S241-Q244 WeakPolarHBondContact OG-CG 3.15Å; S241-Q244 PolarHBondContact OG-N 3.37Å; S241-Q244 PolarHBondContact OG-OE1 3.42Å; S241-V245 PolarHBondContact O-N 3.48Å | ||
| 242 | D | 98.1 | Very high | 98.2 | Very high | 62 Ų | 62 | 63.3 Ų | 63.3 | 33% | 0.332 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -41 | -42.4 | 167.5 | -110.8 | 69.5 | 0 | 0 | 0 | 112.8 | R231 S235 K246 | R231-D242 WeakPolarHBondContact CD-O 3.45Å; R231-D242 VanDerWaalsContact CD-OD2 3.32Å; R231-D242 WeakPolarHBondContact CD-OD2 3.47Å; S235-D242 PolarHBondContact OG-N 3.23Å; D242-K246 VanDerWaalsContact O-CB 3.25Å; D242-K246 WeakPolarHBondContact O-CB 3.44Å; D242-K246 PolarHBondContact O-N 3.42Å |
| 243 | Q | 97.6 | Very high | 98.2 | Very high | 134 Ų | 134 | 62.3 Ų | 62.3 | 63% | 0.626 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -68.6 | -40.1 | 178.3 | -176.5 | 175.2 | -3.8 | 0 | 0 | 112.4 | S241 I247 | S241-Q243 PolarHBondContact O-N 2.98Å; Q243-I247 HydrophobicContact CG-CD1 3.75Å; Q243-I247 HydrophobicContact CG-CG1 4.41Å; Q243-I247 VanDerWaalsContact O-CB 3.29Å; Q243-I247 WeakPolarHBondContact O-CB 3.3Å; Q243-I247 WeakPolarHBondContact O-CG1 3.27Å; Q243-I247 PolarHBondContact O-N 2.8Å |
| 244 | Q | 98 | Very high | 98.2 | Very high | 74 Ų | 74 | 63.9 Ų | 63.9 | 35% | 0.346 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -64.4 | -43.6 | 174.7 | -76.9 | 163.7 | -82.8 | 0 | 0 | 111.6 | Y208 L240 S241 I247 W248 | Y208-Q244 WeakPolarHBondContact OH-CB 3.26Å; L240-Q244 HydrophobicContact CB-CB 4.36Å; S241-Q244 WeakPolarHBondContact O-CA 3.4Å; S241-Q244 WeakPolarHBondContact O-CB 3.02Å; S241-Q244 PolarHBondContact O-N 3.29Å; S241-Q244 WeakPolarHBondContact OG-CG 3.15Å; S241-Q244 PolarHBondContact OG-N 3.37Å; S241-Q244 PolarHBondContact OG-OE1 3.42Å; Q244-I247 PolarHBondContact O-N 2.99Å; Q244-W248 WeakPolarHBondContact O-CB 3.48Å; Q244-W248 PolarHBondContact O-N 2.98Å |
| 245 | V | 98.4 | Very high | 98.2 | Very high | 0 Ų | 0 | 69.4 Ų | 69.4 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.2 | -47.4 | 175.8 | -177.6 | 0 | 0 | 0 | 0 | 110.4 | L216 I226 R231 L234 L240 S241 I247 W248 F249 | L216-V245 HydrophobicContact CD2-CG1 4.01Å; I226-V245 HydrophobicContact CD1-CG1 3.77Å; R231-V245 HydrophobicContact CG-CB 3.97Å; R231-V245 HydrophobicContact CG-CG1 3.86Å; L234-V245 HydrophobicContact CB-CG1 4.21Å; L234-V245 HydrophobicContact CB-CG2 4.48Å; L234-V245 HydrophobicContact CD1-CG1 4.48Å; L240-V245 HydrophobicContact CB-CG2 4.08Å; L240-V245 HydrophobicContact CD1-CG2 4.46Å; S241-V245 PolarHBondContact O-N 3.48Å; V245-I247 PolarHBondContact O-N 3.32Å; V245-W248 PolarHBondContact O-N 2.92Å; V245-F249 HydrophobicContact CG1-CD2 4.04Å; V245-F249 HydrophobicContact CG1-CE2 4.15Å; V245-F249 WeakPolarHBondContact O-CD2 3.29Å; V245-F249 PolarHBondContact O-N 3.09Å |
| 246 | K | 98.3 | Very high | 98.2 | Very high | 103 Ų | 103 | 72.2 Ų | 72.2 | 45% | 0.448 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -56.1 | -46.7 | 174.9 | -178.7 | -178.5 | 177.8 | -177.5 | 0 | 112.3 | D242 F249 Q250 | D242-K246 VanDerWaalsContact O-CB 3.25Å; D242-K246 WeakPolarHBondContact O-CB 3.44Å; D242-K246 PolarHBondContact O-N 3.42Å; K246-F249 PolarHBondContact O-N 3.11Å; K246-Q250 WeakPolarHBondContact O-CG 3.44Å; K246-Q250 PolarHBondContact O-N 3.18Å; K246-Q250 VanDerWaalsContact O-N 3.11Å |
| 247 | I | 98.3 | Very high | 98.2 | Very high | 63 Ų | 63 | 72.4 Ų | 72.4 | 32% | 0.323 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -67.8 | -37.1 | 178.5 | -73.3 | 171.5 | 0 | 0 | 0 | 111 | Q243 Q244 V245 Q250 N251 | Q243-I247 HydrophobicContact CG-CD1 3.75Å; Q243-I247 HydrophobicContact CG-CG1 4.41Å; Q243-I247 VanDerWaalsContact O-CB 3.29Å; Q243-I247 WeakPolarHBondContact O-CB 3.3Å; Q243-I247 WeakPolarHBondContact O-CG1 3.27Å; Q243-I247 PolarHBondContact O-N 2.8Å; Q244-I247 PolarHBondContact O-N 2.99Å; V245-I247 PolarHBondContact O-N 3.32Å; I247-Q250 PolarHBondContact O-N 3.11Å; I247-N251 VanDerWaalsContact CG2-ND2 3.31Å; I247-N251 WeakPolarHBondContact CG2-ND2 3.46Å; I247-N251 WeakPolarHBondContact O-CB 3.32Å; I247-N251 VanDerWaalsContact O-CG 3.29Å; I247-N251 PolarHBondContact O-N 3Å; I247-N251 PolarHBondContact O-ND2 3.41Å |
| 248 | W | 98.5 | Very high | 98.1 | Very high | 19 Ų | 19 | 76.3 Ų | 76.3 | 7% | 0.072 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -62.2 | -48.6 | 175.2 | -172.6 | 105.5 | 0 | 0 | 0 | 110.8 | Y208 L216 E217 Y220 Q244 V245 Q250 N251 R252 | Y208-W248 AromaticContact CD2-CD1 3.86Å; Y208-W248 AromaticContact CE2-CD1 3.72Å; L216-W248 HydrophobicContact CB-CD2 3.88Å; L216-W248 HydrophobicContact CB-CE3 3.91Å; L216-W248 HydrophobicContact CB-CH2 3.68Å; L216-W248 HydrophobicContact CB-CZ2 3.6Å; L216-W248 HydrophobicContact CB-CZ3 3.82Å; L216-W248 HydrophobicContact CD1-CB 4.45Å; L216-W248 HydrophobicContact CD1-CD2 3.92Å; L216-W248 HydrophobicContact CD1-CG 3.81Å; L216-W248 HydrophobicContact CD2-CE3 4.39Å; L216-W248 HydrophobicContact CG-CD2 4.33Å; L216-W248 VanDerWaalsContact O-CH2 3.27Å; L216-W248 WeakPolarHBondContact O-CH2 3.48Å; L216-W248 WeakPolarHBondContact O-CZ3 3.48Å; E217-W248 HydrophobicContact CG-CH2 4.25Å; E217-W248 HydrophobicContact CG-CZ2 4.26Å; E217-W248 WeakPolarHBondContact OE1-CZ2 3.38Å; Y220-W248 HydrophobicContact CD2-CZ3 4.16Å; Y220-W248 HydrophobicContact CG-CZ3 4.34Å; Q244-W248 WeakPolarHBondContact O-CB 3.48Å; Q244-W248 PolarHBondContact O-N 2.98Å; V245-W248 PolarHBondContact O-N 2.92Å; W248-Q250 VanDerWaalsContact C-N 3.3Å; W248-Q250 PolarHBondContact O-N 3.22Å; W248-N251 CarbonylContact O-C 3.57Å; W248-N251 PolarHBondContact O-N 2.86Å; W248-N251 VanDerWaalsContact O-N 3.11Å; W248-R252 HydrophobicContact CD2-CB 4.38Å; W248-R252 HydrophobicContact CE3-CB 3.89Å; W248-R252 HydrophobicContact CE3-CG 4.39Å; W248-R252 HydrophobicContact CH2-CB 3.9Å; W248-R252 HydrophobicContact CH2-CG 3.51Å; W248-R252 HydrophobicContact CZ2-CB 4.4Å; W248-R252 HydrophobicContact CZ2-CG 4.22Å; W248-R252 HydrophobicContact CZ3-CB 3.62Å; W248-R252 HydrophobicContact CZ3-CG 3.62Å; W248-R252 WeakPolarHBondContact O-CB 3.36Å; W248-R252 PolarHBondContact O-N 2.89Å |
| 249 | F | 98.8 | Very high | 98.1 | Very high | 5 Ų | 5 | 79.4 Ų | 79.4 | 2% | 0.022 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -63.3 | -32.8 | 177.9 | -90.8 | -98.4 | 0 | 0 | 0 | 113.3 | L216 E219 Y220 I226 L234 V245 K246 R253 | L216-F249 HydrophobicContact CD2-CE2 3.99Å; E219-F249 HydrophobicContact CB-CZ 4.38Å; Y220-F249 AromaticContact CD2-CD1 3.86Å; Y220-F249 HydrophobicContact CD2-CD1 3.86Å; Y220-F249 AromaticContact CD2-CE1 3.85Å; Y220-F249 HydrophobicContact CD2-CE1 3.85Å; Y220-F249 HydrophobicContact CG-CE1 4.46Å; I226-F249 HydrophobicContact CB-CD1 3.86Å; I226-F249 HydrophobicContact CB-CD2 4.1Å; I226-F249 HydrophobicContact CB-CE1 3.84Å; I226-F249 HydrophobicContact CB-CE2 4.09Å; I226-F249 HydrophobicContact CB-CG 4Å; I226-F249 HydrophobicContact CB-CZ 3.97Å; I226-F249 HydrophobicContact CD1-CD2 4.21Å; I226-F249 HydrophobicContact CD1-CE2 3.71Å; I226-F249 HydrophobicContact CD1-CZ 3.99Å; I226-F249 HydrophobicContact CG1-CE2 4.46Å; I226-F249 HydrophobicContact CG1-CZ 4.41Å; I226-F249 HydrophobicContact CG2-CB 4.02Å; I226-F249 HydrophobicContact CG2-CD1 3.97Å; I226-F249 HydrophobicContact CG2-CD2 3.75Å; I226-F249 HydrophobicContact CG2-CE1 4.41Å; I226-F249 HydrophobicContact CG2-CE2 4.22Å; I226-F249 HydrophobicContact CG2-CG 3.62Å; L234-F249 HydrophobicContact CD1-CE2 4.24Å; V245-F249 HydrophobicContact CG1-CD2 4.04Å; V245-F249 HydrophobicContact CG1-CE2 4.15Å; V245-F249 WeakPolarHBondContact O-CD2 3.29Å; V245-F249 PolarHBondContact O-N 3.09Å; K246-F249 PolarHBondContact O-N 3.11Å; F249-R253 PolarHBondContact O-N 3.07Å; F249-R253 PolarHBondContact O-NE 2.82Å |
| 250 | Q | 98.6 | Very high | 97.9 | Very high | 87 Ų | 87 | 77.3 Ų | 77.3 | 41% | 0.407 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -65.6 | -49.4 | 170.5 | -72.8 | 172.4 | -24.9 | 0 | 0 | 111.3 | K246 I247 W248 R252 R253 M254 | K246-Q250 WeakPolarHBondContact O-CG 3.44Å; K246-Q250 PolarHBondContact O-N 3.18Å; K246-Q250 VanDerWaalsContact O-N 3.11Å; I247-Q250 PolarHBondContact O-N 3.11Å; W248-Q250 VanDerWaalsContact C-N 3.3Å; W248-Q250 PolarHBondContact O-N 3.22Å; Q250-R252 VanDerWaalsContact C-N 3.33Å; Q250-R252 PolarHBondContact O-N 2.73Å; Q250-R253 PolarHBondContact O-N 3.15Å; Q250-M254 WeakPolarHBondContact O-CG 3.37Å; Q250-M254 PolarHBondContact O-N 2.94Å; Q250-M254 VanDerWaalsContact O-N 3.09Å |
| 251 | N | 98.4 | Very high | 97.8 | Very high | 91 Ų | 91 | 82.1 Ų | 82.1 | 49% | 0.487 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -63.4 | -36 | 178 | -72 | -42.7 | 0 | 0 | 0 | 112.7 | I247 W248 M254 K255 | I247-N251 VanDerWaalsContact CG2-ND2 3.31Å; I247-N251 WeakPolarHBondContact CG2-ND2 3.46Å; I247-N251 WeakPolarHBondContact O-CB 3.32Å; I247-N251 VanDerWaalsContact O-CG 3.29Å; I247-N251 PolarHBondContact O-N 3Å; I247-N251 PolarHBondContact O-ND2 3.41Å; W248-N251 CarbonylContact O-C 3.57Å; W248-N251 PolarHBondContact O-N 2.86Å; W248-N251 VanDerWaalsContact O-N 3.11Å; N251-M254 PolarHBondContact O-N 2.92Å; N251-K255 WeakPolarHBondContact O-CB 3.44Å; N251-K255 PolarHBondContact O-N 2.99Å |
| 252 | R | 98.6 | Very high | 97.7 | Very high | 55 Ų | 55 | 86.2 Ų | 86.2 | 21% | 0.208 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -67.8 | -40 | -179.3 | -175.4 | 63.5 | -179.4 | 71.8 | 1.9 | 112.5 | E217 Y220 W248 Q250 K255 K256 | E217-R252 IonicContact OE1-NE 2.69Å; Y220-R252 HydrophobicContact CD1-CG 3.92Å; Y220-R252 HydrophobicContact CD2-CB 3.99Å; Y220-R252 HydrophobicContact CD2-CG 3.38Å; Y220-R252 HydrophobicContact CE1-CG 4.01Å; Y220-R252 HydrophobicContact CE2-CB 3.91Å; Y220-R252 HydrophobicContact CE2-CG 3.44Å; Y220-R252 VanDerWaalsContact CE2-CG 3.44Å; Y220-R252 HydrophobicContact CG-CG 3.64Å; W248-R252 HydrophobicContact CD2-CB 4.38Å; W248-R252 HydrophobicContact CE3-CB 3.89Å; W248-R252 HydrophobicContact CE3-CG 4.39Å; W248-R252 HydrophobicContact CH2-CB 3.9Å; W248-R252 HydrophobicContact CH2-CG 3.51Å; W248-R252 HydrophobicContact CZ2-CB 4.4Å; W248-R252 HydrophobicContact CZ2-CG 4.22Å; W248-R252 HydrophobicContact CZ3-CB 3.62Å; W248-R252 HydrophobicContact CZ3-CG 3.62Å; W248-R252 WeakPolarHBondContact O-CB 3.36Å; W248-R252 PolarHBondContact O-N 2.89Å; Q250-R252 VanDerWaalsContact C-N 3.33Å; Q250-R252 PolarHBondContact O-N 2.73Å; R252-K255 PolarHBondContact O-N 2.83Å; R252-K256 PolarHBondContact O-N 3.45Å |
| 253 | R | 98.5 | Very high | 97.4 | Very high | 80 Ų | 80 | 86.6 Ų | 86.6 | 30% | 0.302 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -65.6 | -42.8 | 169.9 | -73.3 | -175.3 | -74.6 | 138.6 | -1.1 | 112 | Y220 E224 F249 Q250 K255 K256 K257 | Y220-R253 HydrophobicContact CE2-CG 3.75Å; Y220-R253 WeakPolarHBondContact OH-CG 3.27Å; E224-R253 HydrophobicContact CB-CG 4.42Å; E224-R253 VanDerWaalsContact O-CD 3.3Å; E224-R253 WeakPolarHBondContact O-CD 3.44Å; E224-R253 PolarHBondContact O-NE 3.4Å; F249-R253 PolarHBondContact O-N 3.07Å; F249-R253 PolarHBondContact O-NE 2.82Å; Q250-R253 PolarHBondContact O-N 3.15Å; R253-K255 VanDerWaalsContact C-N 3.31Å; R253-K255 PolarHBondContact O-N 2.81Å; R253-K256 PolarHBondContact O-N 2.88Å; R253-K257 PolarHBondContact O-N 3.41Å |
| 254 | M | 98.5 | Very high | 97.2 | Very high | 99 Ų | 99 | 85.7 Ų | 85.7 | 49% | 0.488 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65 | -33.1 | 175.6 | -68.2 | -55.9 | -64.6 | 0 | 0 | 112.8 | Q250 N251 R258 | Q250-M254 WeakPolarHBondContact O-CG 3.37Å; Q250-M254 PolarHBondContact O-N 2.94Å; Q250-M254 VanDerWaalsContact O-N 3.09Å; N251-M254 PolarHBondContact O-N 2.92Å; M254-R258 WeakPolarHBondContact O-CB 3.29Å; M254-R258 VanDerWaalsContact O-CG 3.26Å; M254-R258 WeakPolarHBondContact O-CG 3.21Å; M254-R258 PolarHBondContact O-N 3.16Å |
| 255 | K | 97.9 | Very high | 96.9 | Very high | 116 Ų | 116 | 84.5 Ų | 84.5 | 50% | 0.504 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -64.3 | -47.8 | 170.7 | -174 | -177.7 | 176.3 | -172.8 | 0 | 110.9 | N251 R252 R253 R258 L259 | N251-K255 WeakPolarHBondContact O-CB 3.44Å; N251-K255 PolarHBondContact O-N 2.99Å; R252-K255 PolarHBondContact O-N 2.83Å; R253-K255 VanDerWaalsContact C-N 3.31Å; R253-K255 PolarHBondContact O-N 2.81Å; K255-R258 PolarHBondContact O-N 3.04Å; K255-L259 HydrophobicContact CG-CD1 4.17Å; K255-L259 WeakPolarHBondContact O-CG 3.32Å; K255-L259 PolarHBondContact O-N 3.35Å |
| 256 | K | 97.7 | Very high | 96.3 | Very high | 76 Ų | 76 | 91 Ų | 91 | 33% | 0.33 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -55.7 | -52.5 | 174.8 | -179.8 | 178.6 | 175.5 | -176.4 | 0 | 111.3 | E224 R252 R253 R258 L259 M260 | E224-K256 WeakPolarHBondContact OE1-CD 3.38Å; E224-K256 WeakPolarHBondContact OE1-CE 3.26Å; E224-K256 IonicContact OE1-NZ 3.68Å; E224-K256 PolarHBondContact OE1-NZ 2.98Å; E224-K256 IonicContact OE2-NZ 2.81Å; E224-K256 PolarHBondContact OE2-NZ 2.87Å; R252-K256 PolarHBondContact O-N 3.45Å; R253-K256 PolarHBondContact O-N 2.88Å; K256-R258 VanDerWaalsContact C-N 3.35Å; K256-R258 PolarHBondContact O-N 2.87Å; K256-L259 PolarHBondContact O-N 3.05Å; K256-M260 HydrophobicContact CD-SD 4.37Å; K256-M260 HydrophobicContact CG-CG 4.43Å; K256-M260 HydrophobicContact CG-SD 3.79Å; K256-M260 WeakPolarHBondContact O-CG 3.11Å; K256-M260 PolarHBondContact O-N 3.34Å |
| 257 | K | 98 | Very high | 95.8 | Very high | 129 Ų | 129 | 90.3 Ų | 90.3 | 56% | 0.561 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -57.7 | -44.7 | 177.9 | -177.1 | 170.3 | -179.9 | 172.5 | 0 | 112.1 | R253 L259 M260 M261 | R253-K257 PolarHBondContact O-N 3.41Å; K257-L259 PolarHBondContact O-N 2.99Å; K257-M260 PolarHBondContact O-N 3.08Å; K257-M261 HydrophobicContact CG-CG 4.16Å; K257-M261 WeakPolarHBondContact O-CG 3.31Å; K257-M261 PolarHBondContact O-N 3.43Å |
| 258 | R | 97.4 | Very high | 94.9 | Very high | 186 Ų | 186 | 93.5 Ų | 93.5 | 70% | 0.702 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -63.2 | -39.1 | 178.9 | -77.6 | 173.5 | 177.1 | 179.1 | -1.2 | 113.2 | M254 K255 K256 R262 | M254-R258 WeakPolarHBondContact O-CB 3.29Å; M254-R258 VanDerWaalsContact O-CG 3.26Å; M254-R258 WeakPolarHBondContact O-CG 3.21Å; M254-R258 PolarHBondContact O-N 3.16Å; K255-R258 PolarHBondContact O-N 3.04Å; K256-R258 VanDerWaalsContact C-N 3.35Å; K256-R258 PolarHBondContact O-N 2.87Å; R258-R262 WeakPolarHBondContact O-CB 3.36Å; R258-R262 PolarHBondContact O-N 2.81Å; R258-R262 VanDerWaalsContact O-N 3.1Å |
| 259 | L | 96.6 | Very high | 93.5 | Very high | 73 Ų | 73 | 105.5 Ų | 105.5 | 38% | 0.382 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64 | -54.6 | 174 | -68.9 | 169.1 | 0 | 0 | 0 | 110.1 | K255 K256 K257 M261 R262 D263 | K255-L259 HydrophobicContact CG-CD1 4.17Å; K255-L259 WeakPolarHBondContact O-CG 3.32Å; K255-L259 PolarHBondContact O-N 3.35Å; K256-L259 PolarHBondContact O-N 3.05Å; K257-L259 PolarHBondContact O-N 2.99Å; L259-M261 VanDerWaalsContact C-N 3.28Å; L259-M261 PolarHBondContact O-N 3.12Å; L259-M261 VanDerWaalsContact O-N 3.14Å; L259-R262 CarbonylContact O-C 3.58Å; L259-R262 WeakPolarHBondContact O-CA 3.41Å; L259-R262 WeakPolarHBondContact O-CB 3.37Å; L259-R262 PolarHBondContact O-N 3.08Å; L259-D263 WeakPolarHBondContact O-CB 3.33Å; L259-D263 PolarHBondContact O-N 2.95Å; L259-D263 VanDerWaalsContact O-OD2 3.08Å |
| 260 | M | 95.1 | Very high | 93.2 | Very high | 109 Ų | 109 | 110.5 Ų | 110.5 | 54% | 0.537 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -54.6 | -39.4 | 179.4 | -65 | 173.1 | 75.2 | 0 | 0 | 113.6 | K256 K257 H264 | K256-M260 HydrophobicContact CD-SD 4.37Å; K256-M260 HydrophobicContact CG-CG 4.43Å; K256-M260 HydrophobicContact CG-SD 3.79Å; K256-M260 WeakPolarHBondContact O-CG 3.11Å; K256-M260 PolarHBondContact O-N 3.34Å; K257-M260 PolarHBondContact O-N 3.08Å; M260-H264 VanDerWaalsContact O-CB 3.32Å; M260-H264 WeakPolarHBondContact O-CB 3.37Å; M260-H264 PolarHBondContact O-N 2.85Å |
| 261 | M | 94.9 | Very high | 92.9 | Very high | 113 Ų | 113 | 111.7 Ų | 111.7 | 56% | 0.557 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -69.4 | -37 | 175.9 | -60.2 | -81.9 | 88.7 | 0 | 0 | 112.7 | K257 L259 A265 | K257-M261 HydrophobicContact CG-CG 4.16Å; K257-M261 WeakPolarHBondContact O-CG 3.31Å; K257-M261 PolarHBondContact O-N 3.43Å; L259-M261 VanDerWaalsContact C-N 3.28Å; L259-M261 PolarHBondContact O-N 3.12Å; L259-M261 VanDerWaalsContact O-N 3.14Å; M261-A265 WeakPolarHBondContact O-CB 3.44Å; M261-A265 PolarHBondContact O-N 2.67Å |
| 262 | R | 94.9 | Very high | 92.6 | Very high | 137 Ų | 137 | 112.9 Ų | 112.9 | 52% | 0.517 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -68.3 | -42.8 | 175.1 | -176.6 | -156.9 | 72.6 | 139.3 | 0.3 | 111.2 | R258 L259 A265 F266 | R258-R262 WeakPolarHBondContact O-CB 3.36Å; R258-R262 PolarHBondContact O-N 2.81Å; R258-R262 VanDerWaalsContact O-N 3.1Å; L259-R262 CarbonylContact O-C 3.58Å; L259-R262 WeakPolarHBondContact O-CA 3.41Å; L259-R262 WeakPolarHBondContact O-CB 3.37Å; L259-R262 PolarHBondContact O-N 3.08Å; R262-A265 WeakPolarHBondContact O-CB 3.4Å; R262-A265 PolarHBondContact O-N 3.07Å; R262-A265 VanDerWaalsContact O-N 3.13Å; R262-F266 HydrophobicContact CG-CD2 3.99Å; R262-F266 HydrophobicContact CG-CE2 3.63Å; R262-F266 VanDerWaalsContact O-CD2 3.29Å; R262-F266 WeakPolarHBondContact O-CD2 3.41Å; R262-F266 PolarHBondContact O-N 2.78Å |
| 263 | D | 92.6 | Very high | 92.3 | Very high | 69 Ų | 69 | 116.3 Ų | 116.3 | 37% | 0.369 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -71.4 | -37.4 | -175.8 | -54.1 | -21.3 | 0 | 0 | 0 | 110 | L259 F266 S267 | L259-D263 WeakPolarHBondContact O-CB 3.33Å; L259-D263 PolarHBondContact O-N 2.95Å; L259-D263 VanDerWaalsContact O-OD2 3.08Å; D263-F266 PolarHBondContact O-N 3.23Å; D263-S267 PolarHBondContact O-N 3.26Å |
| 264 | H | 92.6 | Very high | 91.9 | Very high | 115 Ų | 115 | 118.6 Ų | 118.6 | 53% | 0.532 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -61.2 | -41.6 | 165.9 | -177.4 | -63.4 | 0 | 0 | 0 | 112.3 | M260 F266 S267 M268 | M260-H264 VanDerWaalsContact O-CB 3.32Å; M260-H264 WeakPolarHBondContact O-CB 3.37Å; M260-H264 PolarHBondContact O-N 2.85Å; H264-F266 VanDerWaalsContact C-N 3.31Å; H264-F266 PolarHBondContact O-N 3.33Å; H264-S267 PolarHBondContact O-N 2.93Å; H264-S267 VanDerWaalsContact O-N 3.14Å; H264-M268 WeakPolarHBondContact O-CG 3.26Å |
| 265 | A | 91.7 | Very high | 91.5 | Very high | 50 Ų | 50 | 119.9 Ų | 119.9 | 41% | 0.413 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -64.9 | -34.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | M261 R262 Y269 | M261-A265 WeakPolarHBondContact O-CB 3.44Å; M261-A265 PolarHBondContact O-N 2.67Å; R262-A265 WeakPolarHBondContact O-CB 3.4Å; R262-A265 PolarHBondContact O-N 3.07Å; R262-A265 VanDerWaalsContact O-N 3.13Å; A265-Y269 WeakPolarHBondContact O-CD2 3.43Å |
| 266 | F | 86.8 | Confident | 91 | Very high | 136 Ų | 136 | 120.1 Ų | 120.1 | 60% | 0.596 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -70.1 | -30.8 | 170.8 | -74.9 | -58.7 | 0 | 0 | 0 | 113.1 | R262 D263 H264 M268 | R262-F266 HydrophobicContact CG-CD2 3.99Å; R262-F266 HydrophobicContact CG-CE2 3.63Å; R262-F266 VanDerWaalsContact O-CD2 3.29Å; R262-F266 WeakPolarHBondContact O-CD2 3.41Å; R262-F266 PolarHBondContact O-N 2.78Å; D263-F266 PolarHBondContact O-N 3.23Å; H264-F266 VanDerWaalsContact C-N 3.31Å; H264-F266 PolarHBondContact O-N 3.33Å; F266-M268 PolarHBondContact O-N 2.97Å |
| 267 | S | 88.3 | Confident | 90.5 | Very high | 89 Ų | 89 | 123.5 Ų | 123.5 | 62% | 0.622 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | 5.3 | 178.4 | -169.7 | 0 | 0 | 0 | 0 | 114.8 | D263 H264 | D263-S267 PolarHBondContact O-N 3.26Å; H264-S267 PolarHBondContact O-N 2.93Å; H264-S267 VanDerWaalsContact O-N 3.14Å |
| 268 | M | 78.4 | Confident | 89.9 | Confident | 130 Ų | 130 | 123.1 Ų | 123.1 | 64% | 0.64 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.9 | 11.1 | -180 | -62.4 | -81.7 | 94.2 | 0 | 0 | 112.6 | H264 F266 | H264-M268 WeakPolarHBondContact O-CG 3.26Å; F266-M268 PolarHBondContact O-N 2.97Å |
| 269 | Y | 69.2 | Low | 89.2 | Confident | 270 Ų | 270 | 117.4 Ų | 117.4 | 100% | 1.059 | 57% | 0.566 | S | S | * | * | trans | -133 | 0 | 177.4 | -70.9 | -78 | 0 | 0 | 0 | 110.4 | A265 | A265-Y269 WeakPolarHBondContact O-CD2 3.43Š|
Retrieved 269 of 269 residues in 128.4 ms
(Link to these results)